| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 34.5 | Very low | 55.5 | Low | 232 Ų | 232 | 103.4 Ų | 103.4 | 100% | 1.143 | 60% | 0.596 | S | S | * | * | 0 | 127.8 | 0 | -67.9 | 179.6 | 173.2 | 0 | 0 | 106.6 | Q3 | M1-Q3 PolarHBondContact O-N 3.06Š| |||
| 2 | P | 36.4 | Very low | 58.1 | Low | 129 Ų | 129 | 103.8 Ų | 103.8 | 84% | 0.838 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 132.9 | 170.4 | 24.3 | -30.2 | 0 | 0 | 0 | 108.1 | A4 | P2-A4 PolarHBondContact O-N 3.32Š|
| 3 | Q | 35 | Very low | 60.4 | Low | 192 Ų | 192 | 102 Ų | 102 | 90% | 0.897 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 130.5 | 176.3 | -79 | 176.1 | -31.6 | 0 | 0 | 108.6 | M1 A5 | M1-Q3 PolarHBondContact O-N 3.06Å; Q3-A5 PolarHBondContact O-N 3.02Å |
| 4 | A | 49.5 | Very low | 62.4 | Low | 95 Ų | 95 | 95.5 Ų | 95.5 | 79% | 0.785 | 56% | 0.563 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 127.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | P2 | P2-A4 PolarHBondContact O-N 3.32Š|
| 5 | A | 52.5 | Low | 64.2 | Low | 55 Ų | 55 | 93.1 Ų | 93.1 | 46% | 0.455 | 54% | 0.54 | S | S | . | . | P | Polyproline II helix | trans | -59 | 143.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q3 R256 | Q3-A5 PolarHBondContact O-N 3.02Å; A5-R256 VanDerWaalsContact CB-NH2 3.33Å |
| 6 | P | 55.6 | Low | 66 | Low | 92 Ų | 92 | 90.9 Ų | 90.9 | 60% | 0.597 | 54% | 0.536 | S | S | * | . | P | Polyproline II helix | trans | -58 | 143.9 | 177 | 23.2 | -32.1 | 0 | 0 | 0 | 109.4 | R256 | P6-R256 PolarHBondContact O-NH2 3.49Š|
| 7 | P | 61 | Low | 67.6 | Low | 61 Ų | 61 | 88.9 Ų | 88.9 | 40% | 0.396 | 53% | 0.525 | S | S | . | . | P | Polyproline II helix | trans | -54.9 | 146.1 | -178.8 | 21.6 | -31.9 | 0 | 0 | 0 | 110.5 | E9 A149 | P7-E9 PolarHBondContact O-N 3.13Å; P7-A149 HydrophobicContact CB-CB 3.97Å |
| 8 | T | 63.5 | Low | 69.1 | Low | 19 Ų | 19 | 84 Ų | 84 | 12% | 0.117 | 50% | 0.496 | C | S | . | . | trans | -75.4 | 93 | 176.7 | -59.3 | 0 | 0 | 0 | 0 | 108.3 | L10 A149 D151 | T8-L10 PolarHBondContact O-N 3.21Å; T8-A149 PolarHBondContact N-O 2.83Å; T8-D151 PolarHBondContact OG1-OD1 3.16Å; T8-D151 VanDerWaalsContact OG1-OD1 3.04Å | ||
| 9 | E | 66.7 | Low | 70.4 | Confident | 173 Ų | 173 | 81.4 Ų | 81.4 | 81% | 0.808 | 48% | 0.479 | S | S | * | . | P | Polyproline II helix | trans | -67.5 | 122.1 | 173.6 | -71 | -172.5 | 178.5 | 0 | 0 | 110.2 | P7 | P7-E9 PolarHBondContact O-N 3.13Š|
| 10 | L | 72.8 | Confident | 71.7 | Confident | 20 Ų | 20 | 82.7 Ų | 82.7 | 11% | 0.105 | 48% | 0.483 | C | S | . | . | P | Polyproline II helix | trans | -74.1 | 128.5 | 173.5 | -71.2 | 172 | 0 | 0 | 0 | 110.1 | T8 E14 R15 V154 G155 V261 | T8-L10 PolarHBondContact O-N 3.21Å; L10-E14 WeakPolarHBondContact CA-OE2 3.46Å; L10-E14 HydrophobicContact CD2-CB 4.25Å; L10-E14 WeakPolarHBondContact CD2-OE2 3.24Å; L10-R15 HydrophobicContact CB-CG 3.58Å; L10-R15 HydrophobicContact CD1-CG 4Å; L10-R15 HydrophobicContact CG-CG 4.46Å; L10-V154 HydrophobicContact CD1-CG1 4.22Å; L10-V154 HydrophobicContact CD2-CG1 3.7Å; L10-G155 VanDerWaalsContact CD1-CA 3.41Å; L10-V261 HydrophobicContact CD2-CG1 3.33Å |
| 11 | V | 83.5 | Confident | 72.9 | Confident | 69 Ų | 69 | 79 Ų | 79 | 42% | 0.418 | 46% | 0.462 | S | S | . | . | P | Polyproline II helix | trans | -69.7 | 151.4 | 173.5 | -59.9 | 0 | 0 | 0 | 0 | 110.2 | S13 E14 R15 | V11-S13 WeakPolarHBondContact CG2-OG 3.43Å; V11-S13 PolarHBondContact O-N 3.4Å; V11-E14 HydrophobicContact CG2-CB 4.1Å; V11-E14 VanDerWaalsContact CG2-CD 3.4Å; V11-E14 HydrophobicContact CG2-CG 3.42Å; V11-E14 VanDerWaalsContact CG2-CG 3.42Å; V11-E14 PolarHBondContact N-OE2 2.76Å; V11-E14 WeakPolarHBondContact O-CB 3.49Å; V11-E14 PolarHBondContact O-N 3.23Å; V11-R15 PolarHBondContact O-N 3.43Å |
| 12 | P | 86.3 | Confident | 75.8 | Confident | 108 Ų | 108 | 68 Ų | 68 | 70% | 0.701 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -54.6 | -33.6 | -175.8 | -29.2 | 35.5 | 0 | 0 | 0 | 114.6 | A16 | P12-A16 WeakPolarHBondContact O-CB 3.34Å; P12-A16 PolarHBondContact O-N 3.32Å |
| 13 | S | 87.7 | Confident | 78.7 | Confident | 81 Ų | 81 | 63.5 Ų | 63.5 | 57% | 0.566 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -67.9 | -37.1 | 176.7 | 54.4 | 0 | 0 | 0 | 0 | 112.8 | V11 A16 V17 | V11-S13 WeakPolarHBondContact CG2-OG 3.43Å; V11-S13 PolarHBondContact O-N 3.4Å; S13-A16 PolarHBondContact O-N 3.43Å; S13-V17 WeakPolarHBondContact O-CG2 3.24Å; S13-V17 PolarHBondContact O-N 2.8Å; S13-V17 VanDerWaalsContact O-N 3.16Å |
| 14 | E | 88.6 | Confident | 81.6 | Confident | 11 Ų | 11 | 58.3 Ų | 58.3 | 5% | 0.051 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -65.3 | -47.4 | 175.3 | -66.9 | 170.6 | 164.1 | 0 | 0 | 110.2 | L10 V11 A16 V17 V18 P258 V262 | L10-E14 WeakPolarHBondContact CA-OE2 3.46Å; L10-E14 HydrophobicContact CD2-CB 4.25Å; L10-E14 WeakPolarHBondContact CD2-OE2 3.24Å; V11-E14 HydrophobicContact CG2-CB 4.1Å; V11-E14 VanDerWaalsContact CG2-CD 3.4Å; V11-E14 HydrophobicContact CG2-CG 3.42Å; V11-E14 VanDerWaalsContact CG2-CG 3.42Å; V11-E14 PolarHBondContact N-OE2 2.76Å; V11-E14 WeakPolarHBondContact O-CB 3.49Å; V11-E14 PolarHBondContact O-N 3.23Å; E14-A16 VanDerWaalsContact C-N 3.33Å; E14-A16 PolarHBondContact O-N 3.44Å; E14-V17 PolarHBondContact O-N 3.49Å; E14-V18 WeakPolarHBondContact O-CG2 3.48Å; E14-V18 PolarHBondContact O-N 3.44Å; E14-P258 VanDerWaalsContact OE1-CA 3.23Å; E14-P258 WeakPolarHBondContact OE1-CA 3.48Å; E14-P258 WeakPolarHBondContact OE1-CB 3.43Å; E14-V262 HydrophobicContact CB-CG2 4.16Å; E14-V262 HydrophobicContact CG-CG2 3.69Å |
| 15 | R | 89.6 | Confident | 83.9 | Confident | 59 Ų | 59 | 53.9 Ų | 53.9 | 22% | 0.223 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -56.5 | -47.8 | 176.8 | -59.7 | -178.3 | 101.9 | 161.9 | 8.1 | 110.8 | L10 V11 V17 V18 L19 V68 Q70 D71 | L10-R15 HydrophobicContact CB-CG 3.58Å; L10-R15 HydrophobicContact CD1-CG 4Å; L10-R15 HydrophobicContact CG-CG 4.46Å; V11-R15 PolarHBondContact O-N 3.43Å; R15-V17 VanDerWaalsContact C-N 3.33Å; R15-V17 PolarHBondContact O-N 3.44Å; R15-V18 PolarHBondContact O-N 3.05Å; R15-L19 WeakPolarHBondContact O-CB 3.29Å; R15-L19 VanDerWaalsContact O-CG 3.22Å; R15-L19 WeakPolarHBondContact O-CG 3.37Å; R15-L19 PolarHBondContact O-N 3.37Å; R15-V68 HydrophobicContact CB-CG1 4.04Å; R15-V68 HydrophobicContact CG-CG1 4.34Å; R15-V68 PolarHBondContact NE-O 2.78Å; R15-V68 PolarHBondContact NH2-O 3Å; R15-Q70 PolarHBondContact NH2-O 2.9Å; R15-D71 IonicContact CZ-OD1 3.16Å; R15-D71 IonicContact NH1-OD1 2.74Å; R15-D71 PolarHBondContact NH1-OD1 3.47Å; R15-D71 IonicContact NH1-OD2 3.92Å; R15-D71 IonicContact NH2-OD1 2.67Å; R15-D71 PolarHBondContact NH2-OD1 3.31Å |
| 16 | A | 93.1 | Very high | 86 | Confident | 58 Ų | 58 | 52.7 Ų | 52.7 | 48% | 0.479 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -58 | -43.1 | 179 | 0 | 0 | 0 | 0 | 0 | 112.7 | P12 S13 E14 L20 | P12-A16 WeakPolarHBondContact O-CB 3.34Å; P12-A16 PolarHBondContact O-N 3.32Å; S13-A16 PolarHBondContact O-N 3.43Å; E14-A16 VanDerWaalsContact C-N 3.33Å; E14-A16 PolarHBondContact O-N 3.44Å; A16-L20 WeakPolarHBondContact O-CB 3.48Å; A16-L20 PolarHBondContact O-N 3.31Å |
| 17 | V | 93.9 | Very high | 87.9 | Confident | 58 Ų | 58 | 54.1 Ų | 54.1 | 35% | 0.352 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -66.5 | -42.9 | 178.9 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | S13 E14 R15 L20 S21 V262 I266 | S13-V17 WeakPolarHBondContact O-CG2 3.24Å; S13-V17 PolarHBondContact O-N 2.8Å; S13-V17 VanDerWaalsContact O-N 3.16Å; E14-V17 PolarHBondContact O-N 3.49Å; R15-V17 VanDerWaalsContact C-N 3.33Å; R15-V17 PolarHBondContact O-N 3.44Å; V17-L20 PolarHBondContact O-N 3.14Å; V17-S21 WeakPolarHBondContact O-CB 3.47Å; V17-S21 PolarHBondContact O-N 3.43Å; V17-V262 HydrophobicContact CB-CG1 4.37Å; V17-V262 HydrophobicContact CG1-CG1 3.67Å; V17-I266 HydrophobicContact CG1-CD1 3.73Å; V17-I266 HydrophobicContact CG1-CG1 3.93Å |
| 18 | V | 93.1 | Very high | 89.6 | Confident | 0 Ų | 0 | 51.5 Ų | 51.5 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.6 | -41.8 | 178.7 | -178.6 | 0 | 0 | 0 | 0 | 111.1 | E14 R15 L20 S21 C22 V68 V154 W156 T269 | E14-V18 WeakPolarHBondContact O-CG2 3.48Å; E14-V18 PolarHBondContact O-N 3.44Å; R15-V18 PolarHBondContact O-N 3.05Å; V18-L20 VanDerWaalsContact C-N 3.35Å; V18-L20 PolarHBondContact O-N 2.92Å; V18-S21 WeakPolarHBondContact O-CB 3.33Å; V18-S21 PolarHBondContact O-N 3.21Å; V18-C22 PolarHBondContact O-N 3.04Å; V18-C22 PolarHBondContact O-SG 3.15Å; V18-V68 HydrophobicContact CB-CG2 4.44Å; V18-V68 HydrophobicContact CG1-CG2 3.73Å; V18-V154 HydrophobicContact CG2-CG1 4Å; V18-W156 HydrophobicContact CG1-CZ3 4.03Å; V18-T269 HydrophobicContact CG1-CG2 4.23Å |
| 19 | L | 94.8 | Very high | 91.1 | Very high | 34 Ų | 34 | 50.6 Ų | 50.6 | 18% | 0.178 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -61.6 | -42.5 | 175.3 | -70.2 | 171.3 | 0 | 0 | 0 | 111.8 | R15 S21 C22 A23 F65 V68 L69 | R15-L19 WeakPolarHBondContact O-CB 3.29Å; R15-L19 VanDerWaalsContact O-CG 3.22Å; R15-L19 WeakPolarHBondContact O-CG 3.37Å; R15-L19 PolarHBondContact O-N 3.37Å; L19-S21 VanDerWaalsContact C-N 3.34Å; L19-S21 PolarHBondContact O-N 2.86Å; L19-C22 WeakPolarHBondContact O-CB 3.38Å; L19-C22 PolarHBondContact O-N 3.35Å; L19-A23 WeakPolarHBondContact O-CB 3.44Å; L19-A23 PolarHBondContact O-N 3.32Å; L19-F65 HydrophobicContact CB-CD2 4.39Å; L19-F65 HydrophobicContact CB-CE2 4.1Å; L19-F65 HydrophobicContact CD2-CD2 3.57Å; L19-F65 HydrophobicContact CD2-CE2 3.67Å; L19-F65 HydrophobicContact CD2-CG 4.07Å; L19-F65 HydrophobicContact CD2-CZ 4.24Å; L19-F65 HydrophobicContact CG-CE2 4.45Å; L19-V68 HydrophobicContact CD1-CG1 4.35Å; L19-V68 HydrophobicContact CD2-CB 3.9Å; L19-V68 HydrophobicContact CD2-CG1 3.84Å; L19-V68 HydrophobicContact CG-CB 4.37Å; L19-V68 HydrophobicContact CG-CG1 3.76Å; L19-L69 HydrophobicContact CD1-CD2 3.83Å; L19-L69 HydrophobicContact CD2-CD2 3.97Å; L19-L69 HydrophobicContact CD2-CG 3.82Å |
| 20 | L | 96.3 | Very high | 92.5 | Very high | 107 Ų | 107 | 43.7 Ų | 43.7 | 56% | 0.56 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -61.1 | -44 | 174.2 | 178.5 | 61.2 | 0 | 0 | 0 | 111.3 | A16 V17 V18 A23 L24 | A16-L20 WeakPolarHBondContact O-CB 3.48Å; A16-L20 PolarHBondContact O-N 3.31Å; V17-L20 PolarHBondContact O-N 3.14Å; V18-L20 VanDerWaalsContact C-N 3.35Å; V18-L20 PolarHBondContact O-N 2.92Å; L20-A23 PolarHBondContact O-N 3.03Å; L20-L24 HydrophobicContact CD1-CD1 4.21Å; L20-L24 HydrophobicContact CD1-CG 4.17Å; L20-L24 HydrophobicContact CG-CD1 4.11Å; L20-L24 HydrophobicContact CG-CG 4.48Å; L20-L24 WeakPolarHBondContact O-CB 3.48Å; L20-L24 VanDerWaalsContact O-CG 3.31Å; L20-L24 WeakPolarHBondContact O-CG 3.45Å; L20-L24 PolarHBondContact O-N 3.3Å |
| 21 | S | 96.3 | Very high | 93.5 | Very high | 6 Ų | 6 | 45.3 Ų | 45.3 | 4% | 0.042 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -60.3 | -46.3 | 175.9 | 178.7 | 0 | 0 | 0 | 0 | 112.1 | V17 V18 L19 A23 L24 S25 T269 F270 | V17-S21 WeakPolarHBondContact O-CB 3.47Å; V17-S21 PolarHBondContact O-N 3.43Å; V18-S21 WeakPolarHBondContact O-CB 3.33Å; V18-S21 PolarHBondContact O-N 3.21Å; L19-S21 VanDerWaalsContact C-N 3.34Å; L19-S21 PolarHBondContact O-N 2.86Å; S21-A23 PolarHBondContact O-N 3.35Å; S21-L24 PolarHBondContact O-N 3.5Å; S21-S25 VanDerWaalsContact O-CB 3.29Å; S21-S25 WeakPolarHBondContact O-CB 3.34Å; S21-S25 PolarHBondContact O-N 3.35Å; S21-T269 WeakPolarHBondContact CB-OG1 3.42Å; S21-T269 PolarHBondContact OG-OG1 3.46Å; S21-F270 WeakPolarHBondContact OG-CB 3.48Å |
| 22 | C | 96.4 | Very high | 93.9 | Very high | 1 Ų | 1 | 42.6 Ų | 42.6 | 1% | 0.007 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -57.9 | -46.7 | 173.1 | -74.2 | 0 | 0 | 0 | 0 | 112.2 | V18 L19 S25 A26 F65 T269 | V18-C22 PolarHBondContact O-N 3.04Å; V18-C22 PolarHBondContact O-SG 3.15Å; L19-C22 WeakPolarHBondContact O-CB 3.38Å; L19-C22 PolarHBondContact O-N 3.35Å; C22-S25 WeakPolarHBondContact O-CB 3.42Å; C22-S25 PolarHBondContact O-N 3.03Å; C22-A26 WeakPolarHBondContact O-CB 3.38Å; C22-A26 PolarHBondContact O-N 2.84Å; C22-F65 HydrophobicContact CB-CB 3.9Å; C22-F65 HydrophobicContact CB-CD2 3.76Å; C22-F65 HydrophobicContact CB-CG 4.34Å; C22-T269 VanDerWaalsContact SG-CB 3.55Å; C22-T269 WeakPolarHBondContact SG-CG2 3.06Å |
| 23 | A | 97.3 | Very high | 94.3 | Very high | 35 Ų | 35 | 39.4 Ų | 39.4 | 29% | 0.289 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -63 | -46.7 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L19 L20 S21 S25 A26 L27 | L19-A23 WeakPolarHBondContact O-CB 3.44Å; L19-A23 PolarHBondContact O-N 3.32Å; L20-A23 PolarHBondContact O-N 3.03Å; S21-A23 PolarHBondContact O-N 3.35Å; A23-S25 VanDerWaalsContact C-N 3.27Å; A23-S25 PolarHBondContact O-N 2.92Å; A23-A26 PolarHBondContact O-N 2.74Å; A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 VanDerWaalsContact O-CG 3.26Å; A23-L27 WeakPolarHBondContact O-CG 3.29Å; A23-L27 PolarHBondContact O-N 3.17Å |
| 24 | L | 96.4 | Very high | 94.5 | Very high | 83 Ų | 83 | 37.4 Ų | 37.4 | 44% | 0.435 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61.8 | -37.2 | 175.7 | -70 | 174.2 | 0 | 0 | 0 | 111.9 | L20 S21 G28 F270 | L20-L24 HydrophobicContact CD1-CD1 4.21Å; L20-L24 HydrophobicContact CD1-CG 4.17Å; L20-L24 HydrophobicContact CG-CD1 4.11Å; L20-L24 HydrophobicContact CG-CG 4.48Å; L20-L24 WeakPolarHBondContact O-CB 3.48Å; L20-L24 VanDerWaalsContact O-CG 3.31Å; L20-L24 WeakPolarHBondContact O-CG 3.45Å; L20-L24 PolarHBondContact O-N 3.3Å; S21-L24 PolarHBondContact O-N 3.5Å; L24-G28 PolarHBondContact O-N 3.32Å; L24-F270 HydrophobicContact CB-CD2 4.4Å; L24-F270 HydrophobicContact CB-CE2 3.92Å; L24-F270 HydrophobicContact CD1-CE2 4.15Å |
| 25 | S | 96.8 | Very high | 94.6 | Very high | 1 Ų | 1 | 37.4 Ų | 37.4 | 1% | 0.007 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -68.3 | -44.7 | 176.7 | -164.5 | 0 | 0 | 0 | 0 | 112.4 | S21 C22 A23 G28 S29 T269 G272 G273 | S21-S25 VanDerWaalsContact O-CB 3.29Å; S21-S25 WeakPolarHBondContact O-CB 3.34Å; S21-S25 PolarHBondContact O-N 3.35Å; C22-S25 WeakPolarHBondContact O-CB 3.42Å; C22-S25 PolarHBondContact O-N 3.03Å; A23-S25 VanDerWaalsContact C-N 3.27Å; A23-S25 PolarHBondContact O-N 2.92Å; S25-G28 PolarHBondContact O-N 2.99Å; S25-S29 WeakPolarHBondContact O-CB 3.25Å; S25-S29 PolarHBondContact O-N 2.93Å; S25-S29 PolarHBondContact O-OG 3.4Å; S25-T269 WeakPolarHBondContact CB-O 3.43Å; S25-T269 PolarHBondContact OG-O 2.93Å; S25-G272 WeakPolarHBondContact OG-CA 3.22Å; S25-G272 PolarHBondContact OG-N 3.04Å; S25-G272 VanDerWaalsContact OG-N 3.13Å; S25-G273 PolarHBondContact OG-N 3.49Å |
| 26 | A | 96.8 | Very high | 94.6 | Very high | 30 Ų | 30 | 35.8 Ų | 35.8 | 25% | 0.248 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.7 | -45 | 176 | 0 | 0 | 0 | 0 | 0 | 111.6 | C22 A23 G30 L58 A61 | C22-A26 WeakPolarHBondContact O-CB 3.38Å; C22-A26 PolarHBondContact O-N 2.84Å; A23-A26 PolarHBondContact O-N 2.74Å; A26-G30 PolarHBondContact O-N 3.48Å; A26-L58 HydrophobicContact CB-CD1 3.81Å; A26-A61 HydrophobicContact CB-CB 4.31Å |
| 27 | L | 96.1 | Very high | 94.5 | Very high | 123 Ų | 123 | 35.8 Ų | 35.8 | 64% | 0.644 | 22% | 0.223 | S | C | * | . | H | α-helix | trans | -61.6 | -43.8 | 174 | -71.1 | 172.2 | 0 | 0 | 0 | 111.5 | A23 G30 L31 | A23-L27 WeakPolarHBondContact O-CB 3.41Å; A23-L27 VanDerWaalsContact O-CG 3.26Å; A23-L27 WeakPolarHBondContact O-CG 3.29Å; A23-L27 PolarHBondContact O-N 3.17Å; L27-G30 PolarHBondContact O-N 3.39Å; L27-L31 WeakPolarHBondContact O-CB 3.34Å; L27-L31 PolarHBondContact O-N 3.06Å |
| 28 | G | 95 | Very high | 94.4 | Very high | 6 Ų | 6 | 38.2 Ų | 38.2 | 6% | 0.062 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.4 | -49.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | L24 S25 L31 L32 C276 | L24-G28 PolarHBondContact O-N 3.32Å; S25-G28 PolarHBondContact O-N 2.99Å; G28-L31 PolarHBondContact O-N 2.98Å; G28-L32 PolarHBondContact O-N 2.92Å; G28-C276 WeakPolarHBondContact O-CB 3.49Å |
| 29 | S | 96 | Very high | 94.1 | Very high | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 175.7 | -69.8 | 0 | 0 | 0 | 0 | 112 | S25 L31 L32 V33 S54 D57 G272 | S25-S29 WeakPolarHBondContact O-CB 3.25Å; S25-S29 PolarHBondContact O-N 2.93Å; S25-S29 PolarHBondContact O-OG 3.4Å; S29-L31 VanDerWaalsContact C-N 3.34Å; S29-L31 PolarHBondContact O-N 2.98Å; S29-L32 WeakPolarHBondContact O-CB 3.37Å; S29-L32 PolarHBondContact O-N 3.44Å; S29-V33 WeakPolarHBondContact O-CG2 3.35Å; S29-V33 PolarHBondContact O-N 3.36Å; S29-S54 WeakPolarHBondContact CB-O 3.27Å; S29-S54 PolarHBondContact OG-O 3.25Å; S29-D57 WeakPolarHBondContact OG-CB 3.34Å; S29-G272 VanDerWaalsContact OG-CA 3.28Å; S29-G272 WeakPolarHBondContact OG-CA 3.3Å |
| 30 | G | 95.8 | Very high | 93.7 | Very high | 28 Ų | 28 | 41.6 Ų | 41.6 | 29% | 0.289 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -60 | -42.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A26 L27 L32 V33 A34 | A26-G30 PolarHBondContact O-N 3.48Å; L27-G30 PolarHBondContact O-N 3.39Å; G30-L32 PolarHBondContact O-N 3.24Å; G30-V33 PolarHBondContact O-N 3.23Å; G30-A34 VanDerWaalsContact O-CB 3.3Å; G30-A34 WeakPolarHBondContact O-CB 3.29Å; G30-A34 PolarHBondContact O-N 2.84Å |
| 31 | L | 93.6 | Very high | 93 | Very high | 54 Ų | 54 | 42.4 Ų | 42.4 | 28% | 0.283 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -65 | -38.7 | 175.6 | -171.1 | 57.6 | 0 | 0 | 0 | 111.9 | L27 G28 S29 A34 T35 V280 L290 | L27-L31 WeakPolarHBondContact O-CB 3.34Å; L27-L31 PolarHBondContact O-N 3.06Å; G28-L31 PolarHBondContact O-N 2.98Å; S29-L31 VanDerWaalsContact C-N 3.34Å; S29-L31 PolarHBondContact O-N 2.98Å; L31-A34 PolarHBondContact O-N 2.99Å; L31-T35 HydrophobicContact CD1-CG2 4.02Å; L31-T35 HydrophobicContact CG-CG2 4.28Å; L31-T35 WeakPolarHBondContact O-CB 3.39Å; L31-T35 WeakPolarHBondContact O-CG2 3.2Å; L31-T35 PolarHBondContact O-N 2.89Å; L31-T35 PolarHBondContact O-OG1 3.42Å; L31-V280 HydrophobicContact CD2-CG1 3.69Å; L31-V280 HydrophobicContact CG-CG1 4.04Å; L31-V280 HydrophobicContact CG-CG2 4.43Å; L31-L290 HydrophobicContact CD1-CD1 4.28Å; L31-L290 HydrophobicContact CD1-CD2 3.96Å; L31-L290 HydrophobicContact CD2-CD1 4.19Å |
| 32 | L | 92.6 | Very high | 92 | Very high | 12 Ų | 12 | 43.2 Ų | 43.2 | 6% | 0.063 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.1 | -44.9 | 173.6 | -78.6 | 168.8 | 0 | 0 | 0 | 112.3 | G28 S29 G30 T35 H36 L50 S54 N275 C276 F279 V280 | G28-L32 PolarHBondContact O-N 2.92Å; S29-L32 WeakPolarHBondContact O-CB 3.37Å; S29-L32 PolarHBondContact O-N 3.44Å; G30-L32 PolarHBondContact O-N 3.24Å; L32-T35 PolarHBondContact O-OG1 2.77Å; L32-T35 VanDerWaalsContact O-OG1 3.1Å; L32-H36 WeakPolarHBondContact O-CB 3.48Å; L32-H36 PolarHBondContact O-N 2.89Å; L32-L50 HydrophobicContact CD2-CD2 4.08Å; L32-S54 VanDerWaalsContact CD1-OG 3.25Å; L32-S54 WeakPolarHBondContact CD1-OG 3.44Å; L32-N275 HydrophobicContact CD1-CB 3.93Å; L32-C276 HydrophobicContact CD1-CB 4.27Å; L32-C276 HydrophobicContact CG-CB 4.43Å; L32-F279 HydrophobicContact CD2-CB 3.82Å; L32-V280 HydrophobicContact CD2-CG2 3.47Å; L32-V280 VanDerWaalsContact CD2-CG2 3.47Å; L32-V280 HydrophobicContact CG-CG2 3.89Å |
| 33 | V | 94.6 | Very high | 91.5 | Very high | 40 Ų | 40 | 48.8 Ų | 48.8 | 24% | 0.242 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -62.3 | -48.5 | 175.9 | 173.9 | 0 | 0 | 0 | 0 | 110.6 | S29 G30 H36 A37 L51 L55 | S29-V33 WeakPolarHBondContact O-CG2 3.35Å; S29-V33 PolarHBondContact O-N 3.36Å; G30-V33 PolarHBondContact O-N 3.23Å; V33-H36 PolarHBondContact O-N 3.3Å; V33-A37 WeakPolarHBondContact O-CB 3.09Å; V33-A37 PolarHBondContact O-N 2.67Å; V33-L51 HydrophobicContact CB-CD1 4.09Å; V33-L51 HydrophobicContact CG1-CD1 4.09Å; V33-L51 HydrophobicContact CG2-CD1 3.81Å; V33-L55 HydrophobicContact CG2-CD2 3.89Å; V33-L55 HydrophobicContact CG2-CG 4.26Å |
| 34 | A | 92.1 | Very high | 90.8 | Very high | 40 Ų | 40 | 49.8 Ų | 49.8 | 33% | 0.331 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -62.3 | -47 | -179.3 | 0 | 0 | 0 | 0 | 0 | 112 | G30 L31 H36 A37 L38 | G30-A34 VanDerWaalsContact O-CB 3.3Å; G30-A34 WeakPolarHBondContact O-CB 3.29Å; G30-A34 PolarHBondContact O-N 2.84Å; L31-A34 PolarHBondContact O-N 2.99Å; A34-H36 VanDerWaalsContact C-N 3.31Å; A34-H36 PolarHBondContact O-N 2.96Å; A34-A37 PolarHBondContact O-N 3.28Å; A34-A37 VanDerWaalsContact O-N 3.12Å; A34-L38 WeakPolarHBondContact O-CB 3.29Å; A34-L38 VanDerWaalsContact O-CG 3.3Å; A34-L38 WeakPolarHBondContact O-CG 3.33Å; A34-L38 PolarHBondContact O-N 3.44Å |
| 35 | T | 90.9 | Very high | 90.1 | Very high | 10 Ų | 10 | 51.3 Ų | 51.3 | 6% | 0.061 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -65.5 | -33.9 | 179.1 | 55.1 | 0 | 0 | 0 | 0 | 112.5 | L31 L32 W39 V286 L290 | L31-T35 HydrophobicContact CD1-CG2 4.02Å; L31-T35 HydrophobicContact CG-CG2 4.28Å; L31-T35 WeakPolarHBondContact O-CB 3.39Å; L31-T35 WeakPolarHBondContact O-CG2 3.2Å; L31-T35 PolarHBondContact O-N 2.89Å; L31-T35 PolarHBondContact O-OG1 3.42Å; L32-T35 PolarHBondContact O-OG1 2.77Å; L32-T35 VanDerWaalsContact O-OG1 3.1Å; T35-W39 HydrophobicContact CG2-CE3 4.06Å; T35-W39 HydrophobicContact CG2-CH2 3.95Å; T35-W39 HydrophobicContact CG2-CZ3 3.33Å; T35-W39 PolarHBondContact O-N 3.01Å; T35-V286 HydrophobicContact CG2-CG1 4.27Å; T35-L290 HydrophobicContact CG2-CD2 4.2Å |
| 36 | H | 89.9 | Confident | 89.4 | Confident | 26 Ų | 26 | 51.5 Ų | 51.5 | 12% | 0.12 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -67.3 | -39 | 171.5 | -176.7 | -79.6 | 0 | 0 | 0 | 112.2 | L32 V33 A34 R43 L51 | L32-H36 WeakPolarHBondContact O-CB 3.48Å; L32-H36 PolarHBondContact O-N 2.89Å; V33-H36 PolarHBondContact O-N 3.3Å; A34-H36 VanDerWaalsContact C-N 3.31Å; A34-H36 PolarHBondContact O-N 2.96Å; H36-R43 PolarHBondContact O-NE 2.91Å; H36-L51 HydrophobicContact CB-CD1 4.21Å |
| 37 | A | 90.6 | Very high | 88.9 | Confident | 57 Ų | 57 | 52.4 Ų | 52.4 | 47% | 0.471 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -69.8 | -44.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | V33 A34 R43 | V33-A37 WeakPolarHBondContact O-CB 3.09Å; V33-A37 PolarHBondContact O-N 2.67Å; A34-A37 PolarHBondContact O-N 3.28Å; A34-A37 VanDerWaalsContact O-N 3.12Å; A37-R43 PolarHBondContact O-NH2 3.35Å |
| 38 | L | 91 | Very high | 88.6 | Confident | 110 Ų | 110 | 52.6 Ų | 52.6 | 58% | 0.576 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -74.2 | -27.8 | -175 | -69.3 | 171 | 0 | 0 | 0 | 113.9 | A34 P40 | A34-L38 WeakPolarHBondContact O-CB 3.29Å; A34-L38 VanDerWaalsContact O-CG 3.3Å; A34-L38 WeakPolarHBondContact O-CG 3.33Å; A34-L38 PolarHBondContact O-N 3.44Å; L38-P40 WeakPolarHBondContact O-CD 3.42Å |
| 39 | W | 87.8 | Confident | 88.4 | Confident | 29 Ų | 29 | 52.3 Ų | 52.3 | 11% | 0.11 | 28% | 0.276 | C | S | . | . | trans | -122.4 | 91.8 | -173.9 | -59.8 | -41.3 | 0 | 0 | 0 | 112.7 | T35 D41 L42 V286 R289 L290 L293 | T35-W39 HydrophobicContact CG2-CE3 4.06Å; T35-W39 HydrophobicContact CG2-CH2 3.95Å; T35-W39 HydrophobicContact CG2-CZ3 3.33Å; T35-W39 PolarHBondContact O-N 3.01Å; W39-D41 PolarHBondContact O-N 3.32Å; W39-L42 HydrophobicContact CB-CB 4.43Å; W39-L42 HydrophobicContact CB-CD1 3.89Å; W39-L42 HydrophobicContact CB-CG 3.93Å; W39-L42 HydrophobicContact CD2-CD1 4.23Å; W39-L42 HydrophobicContact CE3-CD1 3.55Å; W39-L42 HydrophobicContact CG-CD1 4.41Å; W39-L42 HydrophobicContact CZ3-CD1 4.41Å; W39-L42 PolarHBondContact O-N 2.96Å; W39-V286 HydrophobicContact CZ3-CG1 3.97Å; W39-R289 HydrophobicContact CH2-CB 3.62Å; W39-R289 HydrophobicContact CZ2-CB 3.32Å; W39-R289 HydrophobicContact CZ2-CG 4.35Å; W39-R289 HydrophobicContact CZ3-CB 4.35Å; W39-L290 HydrophobicContact CH2-CD2 3.83Å; W39-L290 HydrophobicContact CH2-CG 3.85Å; W39-L293 HydrophobicContact CZ2-CD1 3.75Å | ||
| 40 | P | 85.4 | Confident | 88.2 | Confident | 75 Ų | 75 | 52.7 Ų | 52.7 | 49% | 0.487 | 28% | 0.278 | S | S | . | . | G | 310 helix | trans | -52.3 | -37.9 | 176.9 | -26.9 | 34.5 | 0 | 0 | 0 | 114 | L38 L42 R43 | L38-P40 WeakPolarHBondContact O-CD 3.42Å; P40-L42 PolarHBondContact O-N 3.04Å; P40-L42 VanDerWaalsContact O-N 3.08Å; P40-R43 VanDerWaalsContact O-CB 3.32Å; P40-R43 WeakPolarHBondContact O-CB 3.33Å; P40-R43 WeakPolarHBondContact O-CG 3.37Å; P40-R43 PolarHBondContact O-N 3.36Å |
| 41 | D | 80.8 | Confident | 88.1 | Confident | 125 Ų | 125 | 52.8 Ų | 52.8 | 67% | 0.668 | 27% | 0.272 | S | S | * | . | G | 310 helix | trans | -58.8 | -24.5 | 179.9 | -38.2 | -38.5 | 0 | 0 | 0 | 113.4 | W39 R289 | W39-D41 PolarHBondContact O-N 3.32Å; D41-R289 IonicContact OD2-CZ 3.59Å; D41-R289 IonicContact OD2-NH1 3.15Å; D41-R289 PolarHBondContact OD2-NH1 3.19Å; D41-R289 VanDerWaalsContact OD2-NH1 3.15Å; D41-R289 IonicContact OD2-NH2 3.01Å; D41-R289 PolarHBondContact OD2-NH2 3.45Å |
| 42 | L | 76.5 | Confident | 88.2 | Confident | 22 Ų | 22 | 51.7 Ų | 51.7 | 12% | 0.115 | 27% | 0.265 | C | S | . | . | G | 310 helix | trans | -86.2 | -11 | -179 | -60.7 | -175.5 | 0 | 0 | 0 | 112.8 | W39 P40 S44 R47 V286 | W39-L42 HydrophobicContact CB-CB 4.43Å; W39-L42 HydrophobicContact CB-CD1 3.89Å; W39-L42 HydrophobicContact CB-CG 3.93Å; W39-L42 HydrophobicContact CD2-CD1 4.23Å; W39-L42 HydrophobicContact CE3-CD1 3.55Å; W39-L42 HydrophobicContact CG-CD1 4.41Å; W39-L42 HydrophobicContact CZ3-CD1 4.41Å; W39-L42 PolarHBondContact O-N 2.96Å; P40-L42 PolarHBondContact O-N 3.04Å; P40-L42 VanDerWaalsContact O-N 3.08Å; L42-S44 PolarHBondContact O-N 3.21Å; L42-R47 WeakPolarHBondContact O-CD 3.11Å; L42-R47 PolarHBondContact O-NE 3.45Å; L42-V286 HydrophobicContact CD1-CG2 3.74Å |
| 43 | R | 84.6 | Confident | 88.4 | Confident | 119 Ų | 119 | 51.1 Ų | 51.1 | 45% | 0.449 | 26% | 0.262 | S | S | . | . | trans | -76.1 | 50.7 | -171.6 | -56.9 | -178.7 | -172.7 | 158.3 | 2.1 | 113.4 | H36 A37 P40 | H36-R43 PolarHBondContact O-NE 2.91Å; A37-R43 PolarHBondContact O-NH2 3.35Å; P40-R43 VanDerWaalsContact O-CB 3.32Å; P40-R43 WeakPolarHBondContact O-CB 3.33Å; P40-R43 WeakPolarHBondContact O-CG 3.37Å; P40-R43 PolarHBondContact O-N 3.36Å | ||
| 44 | S | 83.3 | Confident | 88.4 | Confident | 55 Ų | 55 | 49.2 Ų | 49.2 | 39% | 0.385 | 25% | 0.25 | S | S | . | . | trans | -62.2 | 156.9 | 167.9 | 77.9 | 0 | 0 | 0 | 0 | 110.2 | L42 A46 R47 R48 | L42-S44 PolarHBondContact O-N 3.21Å; S44-A46 VanDerWaalsContact C-N 3.25Å; S44-A46 PolarHBondContact O-N 3.45Å; S44-R47 CarbonylContact O-C 3.5Å; S44-R47 WeakPolarHBondContact O-CA 3.43Å; S44-R47 PolarHBondContact O-N 2.87Å; S44-R47 PolarHBondContact OG-N 3.41Å; S44-R48 PolarHBondContact O-N 2.83Å | ||
| 45 | R | 82.8 | Confident | 88.7 | Confident | 115 Ų | 115 | 50.5 Ų | 50.5 | 43% | 0.434 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -56 | -40.6 | 179 | -64.8 | 177.6 | -167.2 | 177 | -4 | 112.4 | R47 R48 L49 Y103 T117 | R45-R47 VanDerWaalsContact C-N 3.33Å; R45-R47 PolarHBondContact O-N 3.46Å; R45-R48 WeakPolarHBondContact O-CB 3.37Å; R45-R48 PolarHBondContact O-N 3.42Å; R45-L49 PolarHBondContact O-N 3.42Å; R45-L49 VanDerWaalsContact O-N 3.09Å; R45-Y103 HydrophobicContact CB-CE2 4.37Å; R45-Y103 WeakPolarHBondContact CB-OH 3.43Å; R45-T117 PolarHBondContact NH1-OG1 2.96Å |
| 46 | A | 82 | Confident | 89 | Confident | 6 Ų | 6 | 50 Ų | 50 | 5% | 0.05 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -61.5 | -39.8 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | S44 R48 L49 L50 Y103 L227 | S44-A46 VanDerWaalsContact C-N 3.25Å; S44-A46 PolarHBondContact O-N 3.45Å; A46-R48 VanDerWaalsContact C-N 3.34Å; A46-L49 PolarHBondContact O-N 2.86Å; A46-L50 PolarHBondContact O-N 3.44Å; A46-Y103 HydrophobicContact CB-CD1 4.38Å; A46-Y103 HydrophobicContact CB-CE1 3.97Å; A46-L227 HydrophobicContact CB-CD1 3.9Å |
| 47 | R | 85 | Confident | 89.4 | Confident | 48 Ų | 48 | 49 Ų | 49 | 18% | 0.181 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -72.1 | -27.6 | 175 | -68.3 | -156.1 | -138.8 | -110.3 | -4.3 | 113.4 | L42 S44 R45 L49 L50 L51 | L42-R47 WeakPolarHBondContact O-CD 3.11Å; L42-R47 PolarHBondContact O-NE 3.45Å; S44-R47 CarbonylContact O-C 3.5Å; S44-R47 WeakPolarHBondContact O-CA 3.43Å; S44-R47 PolarHBondContact O-N 2.87Å; S44-R47 PolarHBondContact OG-N 3.41Å; R45-R47 VanDerWaalsContact C-N 3.33Å; R45-R47 PolarHBondContact O-N 3.46Å; R47-L49 VanDerWaalsContact C-N 3.35Å; R47-L50 WeakPolarHBondContact O-CB 3.43Å; R47-L50 PolarHBondContact O-N 3.23Å; R47-L51 PolarHBondContact O-N 3.04Å |
| 48 | R | 89.6 | Confident | 89.7 | Confident | 127 Ų | 127 | 48.9 Ų | 48.9 | 48% | 0.479 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -65.6 | -38.7 | 171.1 | -169.1 | 179.9 | 176.9 | 176.9 | -0.6 | 111.4 | S44 R45 A46 L51 F52 | S44-R48 PolarHBondContact O-N 2.83Å; R45-R48 WeakPolarHBondContact O-CB 3.37Å; R45-R48 PolarHBondContact O-N 3.42Å; A46-R48 VanDerWaalsContact C-N 3.34Å; R48-L51 WeakPolarHBondContact O-CB 3.26Å; R48-L51 PolarHBondContact O-N 2.87Å; R48-F52 HydrophobicContact CG-CE2 3.76Å; R48-F52 HydrophobicContact CG-CZ 4.26Å; R48-F52 WeakPolarHBondContact O-CD2 3.29Å; R48-F52 WeakPolarHBondContact O-CE2 3.33Å; R48-F52 PolarHBondContact O-N 2.93Å |
| 49 | L | 91.5 | Very high | 90 | Very high | 1 Ų | 1 | 46.4 Ų | 46.4 | 1% | 0.005 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -65.1 | -42.4 | 171.4 | -60 | 174.4 | 0 | 0 | 0 | 111.4 | R45 A46 R47 L51 F52 L53 W96 I100 Y103 L121 F124 | R45-L49 PolarHBondContact O-N 3.42Å; R45-L49 VanDerWaalsContact O-N 3.09Å; A46-L49 PolarHBondContact O-N 2.86Å; R47-L49 VanDerWaalsContact C-N 3.35Å; L49-L51 VanDerWaalsContact C-N 3.27Å; L49-L51 PolarHBondContact O-N 3.36Å; L49-F52 PolarHBondContact O-N 3.37Å; L49-F52 VanDerWaalsContact O-N 3.17Å; L49-L53 PolarHBondContact O-N 2.97Å; L49-W96 HydrophobicContact CD2-CE3 4.24Å; L49-W96 HydrophobicContact CD2-CZ3 3.55Å; L49-I100 HydrophobicContact CB-CD1 4.3Å; L49-I100 HydrophobicContact CB-CG1 3.6Å; L49-I100 HydrophobicContact CD1-CG1 4.35Å; L49-Y103 HydrophobicContact CD1-CD1 3.89Å; L49-Y103 HydrophobicContact CD1-CD2 4Å; L49-Y103 HydrophobicContact CD1-CG 3.52Å; L49-L121 HydrophobicContact CD2-CD2 3.74Å; L49-L121 HydrophobicContact CG-CD2 4.35Å; L49-F124 HydrophobicContact CD1-CD2 4.4Å; L49-F124 HydrophobicContact CD1-CE2 4.3Å; L49-F124 HydrophobicContact CD2-CD2 3.78Å; L49-F124 HydrophobicContact CD2-CE2 4.47Å |
| 50 | L | 91.4 | Very high | 90.4 | Very high | 7 Ų | 7 | 45.2 Ų | 45.2 | 4% | 0.037 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.7 | -37.2 | 175 | -176.2 | 64.2 | 0 | 0 | 0 | 112.1 | L32 A46 R47 F52 L53 S54 F279 | L32-L50 HydrophobicContact CD2-CD2 4.08Å; A46-L50 PolarHBondContact O-N 3.44Å; R47-L50 WeakPolarHBondContact O-CB 3.43Å; R47-L50 PolarHBondContact O-N 3.23Å; L50-F52 PolarHBondContact O-N 3.23Å; L50-L53 HydrophobicContact CD1-CD2 4.25Å; L50-L53 WeakPolarHBondContact O-CB 3.43Å; L50-L53 PolarHBondContact O-N 3.44Å; L50-S54 PolarHBondContact O-N 2.86Å; L50-S54 PolarHBondContact O-OG 3.1Å; L50-F279 HydrophobicContact CD1-CD2 4Å; L50-F279 HydrophobicContact CD1-CE2 4.23Å; L50-F279 HydrophobicContact CD2-CB 3.79Å; L50-F279 HydrophobicContact CD2-CD1 3.97Å; L50-F279 HydrophobicContact CD2-CD2 3.59Å; L50-F279 HydrophobicContact CD2-CE2 4.31Å; L50-F279 HydrophobicContact CD2-CG 3.45Å; L50-F279 VanDerWaalsContact CD2-CG 3.45Å; L50-F279 HydrophobicContact CG-CD2 4.47Å |
| 51 | L | 94.3 | Very high | 90.9 | Very high | 30 Ų | 30 | 41.7 Ų | 41.7 | 16% | 0.157 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -56.9 | -48 | 174.1 | 174.7 | 72.5 | 0 | 0 | 0 | 111.4 | V33 H36 R47 R48 L49 S54 L55 | V33-L51 HydrophobicContact CB-CD1 4.09Å; V33-L51 HydrophobicContact CG1-CD1 4.09Å; V33-L51 HydrophobicContact CG2-CD1 3.81Å; H36-L51 HydrophobicContact CB-CD1 4.21Å; R47-L51 PolarHBondContact O-N 3.04Å; R48-L51 WeakPolarHBondContact O-CB 3.26Å; R48-L51 PolarHBondContact O-N 2.87Å; L49-L51 VanDerWaalsContact C-N 3.27Å; L49-L51 PolarHBondContact O-N 3.36Å; L51-S54 PolarHBondContact O-N 2.69Å; L51-L55 HydrophobicContact CG-CD1 4.32Å; L51-L55 WeakPolarHBondContact O-CG 3.29Å; L51-L55 PolarHBondContact O-N 2.85Å |
| 52 | F | 96.2 | Very high | 91.7 | Very high | 31 Ų | 31 | 38.4 Ų | 38.4 | 14% | 0.136 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -68.4 | -36.1 | -179.4 | -60.7 | -57.2 | 0 | 0 | 0 | 112.5 | R48 L49 L50 L55 A56 W96 H125 W129 | R48-F52 HydrophobicContact CG-CE2 3.76Å; R48-F52 HydrophobicContact CG-CZ 4.26Å; R48-F52 WeakPolarHBondContact O-CD2 3.29Å; R48-F52 WeakPolarHBondContact O-CE2 3.33Å; R48-F52 PolarHBondContact O-N 2.93Å; L49-F52 PolarHBondContact O-N 3.37Å; L49-F52 VanDerWaalsContact O-N 3.17Å; L50-F52 PolarHBondContact O-N 3.23Å; F52-L55 HydrophobicContact CD1-CD1 4.13Å; F52-L55 PolarHBondContact O-N 3.01Å; F52-A56 PolarHBondContact O-N 3.25Å; F52-W96 HydrophobicContact CB-CD2 3.78Å; F52-W96 VanDerWaalsContact CB-CE2 3.46Å; F52-W96 HydrophobicContact CB-CE3 4.12Å; F52-W96 HydrophobicContact CB-CG 4.42Å; F52-W96 HydrophobicContact CB-CH2 3.95Å; F52-W96 HydrophobicContact CB-CZ2 3.58Å; F52-W96 HydrophobicContact CB-CZ3 4.21Å; F52-W96 AromaticContact CD2-CH2 3.72Å; F52-W96 HydrophobicContact CD2-CH2 3.72Å; F52-W96 HydrophobicContact CD2-CZ2 4.09Å; F52-W96 HydrophobicContact CD2-CZ3 4.09Å; F52-W96 HydrophobicContact CG-CH2 4.04Å; F52-W96 AromaticContact CG-CZ2 3.92Å; F52-W96 HydrophobicContact CG-CZ2 3.92Å; F52-H125 AromaticContact CD1-CE1 3.87Å; F52-H125 AromaticContact CD2-CE1 3.49Å; F52-H125 VanDerWaalsContact CD2-CE1 3.49Å; F52-H125 WeakPolarHBondContact CD2-CE1 3.14Å; F52-H125 AromaticContact CD2-NE2 3.81Å; F52-H125 AromaticContact CE1-CE1 3.59Å; F52-H125 AromaticContact CE2-CE1 3.16Å; F52-H125 WeakPolarHBondContact CE2-CE1 3.47Å; F52-H125 AromaticContact CE2-NE2 3.19Å; F52-H125 WeakPolarHBondContact CE2-NE2 3.36Å; F52-H125 AromaticContact CG-CE1 3.86Å; F52-H125 AromaticContact CZ-CE1 3.23Å; F52-H125 WeakPolarHBondContact CZ-CE1 3.26Å; F52-H125 AromaticContact CZ-NE2 3.51Å; F52-W129 HydrophobicContact CB-CZ2 4.1Å; F52-W129 HydrophobicContact CD1-CZ2 4.5Å |
| 53 | L | 95.6 | Very high | 92.6 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.6 | -48.3 | 168.9 | 178.3 | 59.5 | 0 | 0 | 0 | 111.1 | L49 L50 L55 A56 D57 S93 W96 I100 | L49-L53 PolarHBondContact O-N 2.97Å; L50-L53 HydrophobicContact CD1-CD2 4.25Å; L50-L53 WeakPolarHBondContact O-CB 3.43Å; L50-L53 PolarHBondContact O-N 3.44Å; L53-L55 VanDerWaalsContact C-N 3.31Å; L53-L55 PolarHBondContact O-N 3.38Å; L53-A56 WeakPolarHBondContact O-CB 3.49Å; L53-A56 PolarHBondContact O-N 3.41Å; L53-A56 VanDerWaalsContact O-N 3.17Å; L53-D57 VanDerWaalsContact O-CG 3.31Å; L53-D57 PolarHBondContact O-N 3.14Å; L53-S93 WeakPolarHBondContact CD1-O 3.42Å; L53-S93 WeakPolarHBondContact CD1-OG 3.15Å; L53-W96 HydrophobicContact CB-CB 3.99Å; L53-W96 HydrophobicContact CD1-CB 3.91Å; L53-I100 HydrophobicContact CB-CD1 4.06Å; L53-I100 HydrophobicContact CD2-CD1 3.68Å |
| 54 | S | 96.3 | Very high | 93.1 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.4 | -34 | 178.6 | -60.1 | 0 | 0 | 0 | 0 | 113.1 | S29 L32 L50 L51 D57 L58 | S29-S54 WeakPolarHBondContact CB-O 3.27Å; S29-S54 PolarHBondContact OG-O 3.25Å; L32-S54 VanDerWaalsContact CD1-OG 3.25Å; L32-S54 WeakPolarHBondContact CD1-OG 3.44Å; L50-S54 PolarHBondContact O-N 2.86Å; L50-S54 PolarHBondContact O-OG 3.1Å; L51-S54 PolarHBondContact O-N 2.69Å; S54-D57 PolarHBondContact O-N 2.87Å; S54-L58 VanDerWaalsContact O-CB 3.25Å; S54-L58 WeakPolarHBondContact O-CB 3.29Å; S54-L58 PolarHBondContact O-N 3.48Å |
| 55 | L | 97.6 | Very high | 93.7 | Very high | 67 Ų | 67 | 33.3 Ų | 33.3 | 35% | 0.351 | 16% | 0.159 | S | C | . | . | H | α-helix | trans | -66.1 | -42.6 | 173.4 | -71.3 | 170.3 | 0 | 0 | 0 | 111.6 | V33 L51 F52 L53 L58 L59 | V33-L55 HydrophobicContact CG2-CD2 3.89Å; V33-L55 HydrophobicContact CG2-CG 4.26Å; L51-L55 HydrophobicContact CG-CD1 4.32Å; L51-L55 WeakPolarHBondContact O-CG 3.29Å; L51-L55 PolarHBondContact O-N 2.85Å; F52-L55 HydrophobicContact CD1-CD1 4.13Å; F52-L55 PolarHBondContact O-N 3.01Å; L53-L55 VanDerWaalsContact C-N 3.31Å; L53-L55 PolarHBondContact O-N 3.38Å; L55-L58 PolarHBondContact O-N 3.33Å; L55-L59 WeakPolarHBondContact O-CB 3.48Å; L55-L59 PolarHBondContact O-N 2.82Å |
| 56 | A | 97.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63.9 | -43.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | F52 L53 L59 S60 W129 | F52-A56 PolarHBondContact O-N 3.25Å; L53-A56 WeakPolarHBondContact O-CB 3.49Å; L53-A56 PolarHBondContact O-N 3.41Å; L53-A56 VanDerWaalsContact O-N 3.17Å; A56-L59 PolarHBondContact O-N 3.23Å; A56-S60 WeakPolarHBondContact O-CB 3.47Å; A56-S60 PolarHBondContact O-N 3.41Å; A56-S60 PolarHBondContact O-OG 3.28Å; A56-W129 HydrophobicContact CB-CH2 3.8Å; A56-W129 HydrophobicContact CB-CZ3 4.07Å |
| 57 | D | 96.8 | Very high | 94.7 | Very high | 4 Ų | 4 | 31.7 Ų | 31.7 | 2% | 0.021 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -64.9 | -40.1 | 177.4 | -70.2 | -19.2 | 0 | 0 | 0 | 111.6 | S29 L53 S54 S60 A61 S93 N275 | S29-D57 WeakPolarHBondContact OG-CB 3.34Å; L53-D57 VanDerWaalsContact O-CG 3.31Å; L53-D57 PolarHBondContact O-N 3.14Å; S54-D57 PolarHBondContact O-N 2.87Å; D57-S60 PolarHBondContact O-N 2.94Å; D57-A61 WeakPolarHBondContact O-CB 3.38Å; D57-A61 PolarHBondContact O-N 2.95Å; D57-S93 WeakPolarHBondContact OD1-CB 3.41Å; D57-S93 PolarHBondContact OD1-OG 2.95Å; D57-N275 PolarHBondContact OD2-ND2 2.91Å |
| 58 | L | 97.1 | Very high | 95 | Very high | 56 Ų | 56 | 29.5 Ų | 29.5 | 29% | 0.293 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -62.2 | -46.1 | 175.7 | -179.5 | 62 | 0 | 0 | 0 | 111.3 | A26 S54 L55 S60 A61 A62 | A26-L58 HydrophobicContact CB-CD1 3.81Å; S54-L58 VanDerWaalsContact O-CB 3.25Å; S54-L58 WeakPolarHBondContact O-CB 3.29Å; S54-L58 PolarHBondContact O-N 3.48Å; L55-L58 PolarHBondContact O-N 3.33Å; L58-S60 VanDerWaalsContact C-N 3.34Å; L58-A61 PolarHBondContact O-N 2.95Å; L58-A62 WeakPolarHBondContact O-CB 3.35Å; L58-A62 PolarHBondContact O-N 3.46Å |
| 59 | L | 97.4 | Very high | 95.1 | Very high | 58 Ų | 58 | 27.6 Ų | 27.6 | 30% | 0.304 | 14% | 0.143 | S | C | . | . | H | α-helix | trans | -65.2 | -39.5 | 178.8 | -169.8 | 60.8 | 0 | 0 | 0 | 111.7 | L55 A56 S63 L85 F88 A89 | L55-L59 WeakPolarHBondContact O-CB 3.48Å; L55-L59 PolarHBondContact O-N 2.82Å; A56-L59 PolarHBondContact O-N 3.23Å; L59-S63 WeakPolarHBondContact O-CB 3.18Å; L59-S63 PolarHBondContact O-N 3.47Å; L59-L85 HydrophobicContact CD1-CD1 3.78Å; L59-L85 HydrophobicContact CD1-CD2 3.87Å; L59-L85 HydrophobicContact CD1-CG 3.98Å; L59-L85 HydrophobicContact CD2-CD1 3.72Å; L59-L85 HydrophobicContact CD2-CG 4.43Å; L59-L85 HydrophobicContact CG-CD1 3.78Å; L59-L85 HydrophobicContact CG-CD2 4.4Å; L59-L85 HydrophobicContact CG-CG 3.98Å; L59-F88 HydrophobicContact CD2-CD1 4.11Å; L59-F88 HydrophobicContact CD2-CE1 4.09Å; L59-A89 HydrophobicContact CB-CB 3.82Å; L59-A89 HydrophobicContact CD2-CB 3.93Å; L59-A89 HydrophobicContact CG-CB 3.83Å |
| 60 | S | 96.2 | Very high | 94.9 | Very high | 4 Ų | 4 | 31.1 Ų | 31.1 | 3% | 0.028 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -62.4 | -49.4 | 174.2 | -56.2 | 0 | 0 | 0 | 0 | 110.9 | A56 D57 L58 A62 S63 Y64 A89 N90 | A56-S60 WeakPolarHBondContact O-CB 3.47Å; A56-S60 PolarHBondContact O-N 3.41Å; A56-S60 PolarHBondContact O-OG 3.28Å; D57-S60 PolarHBondContact O-N 2.94Å; L58-S60 VanDerWaalsContact C-N 3.34Å; S60-A62 VanDerWaalsContact C-N 3.34Å; S60-A62 PolarHBondContact O-N 3.49Å; S60-S63 PolarHBondContact O-N 3.4Å; S60-Y64 WeakPolarHBondContact O-CD2 3.42Å; S60-Y64 PolarHBondContact O-N 2.86Å; S60-A89 WeakPolarHBondContact OG-CB 3.31Å; S60-A89 PolarHBondContact OG-O 2.86Å; S60-N90 WeakPolarHBondContact OG-CA 3.32Å; S60-N90 PolarHBondContact OG-N 3.07Å; S60-N90 VanDerWaalsContact OG-N 3.16Å |
| 61 | A | 96.6 | Very high | 94.6 | Very high | 1 Ų | 1 | 36 Ų | 36 | 1% | 0.008 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.1 | -41.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | A26 D57 L58 F65 | A26-A61 HydrophobicContact CB-CB 4.31Å; D57-A61 WeakPolarHBondContact O-CB 3.38Å; D57-A61 PolarHBondContact O-N 2.95Å; L58-A61 PolarHBondContact O-N 2.95Å; A61-F65 WeakPolarHBondContact O-CB 3.19Å; A61-F65 PolarHBondContact O-N 2.91Å |
| 62 | A | 96.6 | Very high | 94 | Very high | 55 Ų | 55 | 35.7 Ų | 35.7 | 46% | 0.455 | 18% | 0.183 | S | C | . | . | H | α-helix | trans | -63.4 | -44.4 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L58 S60 F65 Y66 | L58-A62 WeakPolarHBondContact O-CB 3.35Å; L58-A62 PolarHBondContact O-N 3.46Å; S60-A62 VanDerWaalsContact C-N 3.34Å; S60-A62 PolarHBondContact O-N 3.49Å; A62-F65 PolarHBondContact O-N 3.44Å; A62-Y66 PolarHBondContact O-N 3.25Å |
| 63 | S | 96.3 | Very high | 93 | Very high | 4 Ų | 4 | 43.4 Ų | 43.4 | 3% | 0.028 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.1 | -46.5 | 177.5 | 176.9 | 0 | 0 | 0 | 0 | 112.2 | L59 S60 Y66 G67 Q82 S86 | L59-S63 WeakPolarHBondContact O-CB 3.18Å; L59-S63 PolarHBondContact O-N 3.47Å; S60-S63 PolarHBondContact O-N 3.4Å; S63-Y66 PolarHBondContact O-N 3.41Å; S63-G67 PolarHBondContact O-N 2.97Å; S63-Q82 WeakPolarHBondContact O-CG 3.41Å; S63-Q82 PolarHBondContact O-NE2 3.3Å; S63-Q82 PolarHBondContact OG-NE2 3.04Å; S63-Q82 PolarHBondContact OG-O 2.82Å; S63-S86 VanDerWaalsContact OG-CB 3.31Å; S63-S86 WeakPolarHBondContact OG-CB 3.47Å; S63-S86 PolarHBondContact OG-N 3.2Å |
| 64 | Y | 95.4 | Very high | 92 | Very high | 8 Ų | 8 | 44.3 Ų | 44.3 | 3% | 0.031 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -66.7 | -37.5 | 177.5 | -67.6 | -48.5 | 0 | 0 | 0 | 112.5 | S60 Y66 G67 V68 N90 W156 N268 T269 | S60-Y64 WeakPolarHBondContact O-CD2 3.42Å; S60-Y64 PolarHBondContact O-N 2.86Å; Y64-Y66 VanDerWaalsContact C-N 3.34Å; Y64-Y66 PolarHBondContact O-N 3.01Å; Y64-G67 PolarHBondContact O-N 3.46Å; Y64-V68 VanDerWaalsContact O-CG2 3.29Å; Y64-V68 WeakPolarHBondContact O-CG2 3.4Å; Y64-V68 PolarHBondContact O-N 3.31Å; Y64-N90 PolarHBondContact OH-ND2 3.4Å; Y64-W156 HydrophobicContact CD1-CB 4.3Å; Y64-W156 AromaticContact CD1-CD1 3.9Å; Y64-W156 AromaticContact CD1-CD2 3.36Å; Y64-W156 HydrophobicContact CD1-CD2 3.36Å; Y64-W156 AromaticContact CD1-CE2 3.6Å; Y64-W156 AromaticContact CD1-CE3 3.7Å; Y64-W156 HydrophobicContact CD1-CE3 3.7Å; Y64-W156 AromaticContact CD1-CG 3.62Å; Y64-W156 HydrophobicContact CD1-CG 3.62Å; Y64-W156 HydrophobicContact CD1-CH2 4.41Å; Y64-W156 HydrophobicContact CD1-CZ2 4.17Å; Y64-W156 HydrophobicContact CD1-CZ3 4.19Å; Y64-W156 AromaticContact CD1-NE1 3.89Å; Y64-W156 AromaticContact CE1-CD1 3.71Å; Y64-W156 AromaticContact CE1-CD2 3.73Å; Y64-W156 HydrophobicContact CE1-CD2 3.73Å; Y64-W156 AromaticContact CE1-CE2 3.45Å; Y64-W156 VanDerWaalsContact CE1-CE2 3.45Å; Y64-W156 HydrophobicContact CE1-CE3 4.39Å; Y64-W156 AromaticContact CE1-CG 3.93Å; Y64-W156 HydrophobicContact CE1-CG 3.93Å; Y64-W156 AromaticContact CE1-CZ2 3.96Å; Y64-W156 HydrophobicContact CE1-CZ2 3.96Å; Y64-W156 AromaticContact CE1-NE1 3.42Å; Y64-W156 HydrophobicContact CG-CD2 4.33Å; Y64-W156 HydrophobicContact CG-CE3 4.25Å; Y64-W156 HydrophobicContact CG-CZ3 4.46Å; Y64-N268 HydrophobicContact CE2-CB 4.36Å; Y64-T269 HydrophobicContact CD2-CG2 3.72Å; Y64-T269 HydrophobicContact CG-CG2 3.95Å |
| 65 | F | 95.3 | Very high | 91.3 | Very high | 77 Ų | 77 | 50.3 Ų | 50.3 | 34% | 0.338 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -59.3 | -46.6 | 174.2 | -171.9 | -92.8 | 0 | 0 | 0 | 111.3 | L19 C22 A61 A62 L69 | L19-F65 HydrophobicContact CB-CD2 4.39Å; L19-F65 HydrophobicContact CB-CE2 4.1Å; L19-F65 HydrophobicContact CD2-CD2 3.57Å; L19-F65 HydrophobicContact CD2-CE2 3.67Å; L19-F65 HydrophobicContact CD2-CG 4.07Å; L19-F65 HydrophobicContact CD2-CZ 4.24Å; L19-F65 HydrophobicContact CG-CE2 4.45Å; C22-F65 HydrophobicContact CB-CB 3.9Å; C22-F65 HydrophobicContact CB-CD2 3.76Å; C22-F65 HydrophobicContact CB-CG 4.34Å; A61-F65 WeakPolarHBondContact O-CB 3.19Å; A61-F65 PolarHBondContact O-N 2.91Å; A62-F65 PolarHBondContact O-N 3.44Å; F65-L69 HydrophobicContact CD1-CD1 3.68Å; F65-L69 HydrophobicContact CD1-CG 4.34Å; F65-L69 HydrophobicContact CE1-CD1 3.29Å; F65-L69 HydrophobicContact CE1-CG 4.14Å; F65-L69 HydrophobicContact CZ-CD1 4.02Å; F65-L69 WeakPolarHBondContact O-CG 3.23Å; F65-L69 PolarHBondContact O-N 3.08Å |
| 66 | Y | 94.5 | Very high | 90.9 | Very high | 88 Ų | 88 | 48.8 Ų | 48.8 | 35% | 0.345 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.7 | -46.7 | 174.3 | 178.1 | -101.5 | 0 | 0 | 0 | 111.5 | A62 S63 Y64 V68 L69 Q70 F72 D78 Q82 | A62-Y66 PolarHBondContact O-N 3.25Å; S63-Y66 PolarHBondContact O-N 3.41Å; Y64-Y66 VanDerWaalsContact C-N 3.34Å; Y64-Y66 PolarHBondContact O-N 3.01Å; Y66-V68 PolarHBondContact O-N 3.4Å; Y66-L69 PolarHBondContact O-N 3.04Å; Y66-Q70 HydrophobicContact CD1-CG 4.38Å; Y66-Q70 HydrophobicContact CD2-CG 4.3Å; Y66-Q70 HydrophobicContact CE1-CG 3.94Å; Y66-Q70 HydrophobicContact CE2-CG 3.83Å; Y66-Q70 WeakPolarHBondContact O-CG 3.16Å; Y66-Q70 PolarHBondContact O-N 2.75Å; Y66-F72 HydrophobicContact CE1-CZ 4.39Å; Y66-D78 HydrophobicContact CE1-CB 4.4Å; Y66-D78 PolarHBondContact OH-OD2 3.44Å; Y66-Q82 HydrophobicContact CD1-CB 4Å; Y66-Q82 HydrophobicContact CD1-CG 3.86Å; Y66-Q82 HydrophobicContact CE1-CB 4.31Å |
| 67 | G | 91.8 | Very high | 90.6 | Very high | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -55.1 | -53 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | S63 Y64 L69 Q70 G155 | S63-G67 PolarHBondContact O-N 2.97Å; Y64-G67 PolarHBondContact O-N 3.46Å; G67-L69 VanDerWaalsContact C-N 3.26Å; G67-L69 PolarHBondContact O-N 3.2Å; G67-Q70 PolarHBondContact O-N 3.5Å; G67-G155 CarbonylContact C-O 3.02Å |
| 68 | V | 91 | Very high | 90.3 | Very high | 1 Ų | 1 | 59.2 Ų | 59.2 | 1% | 0.006 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.4 | -29.8 | -177.1 | 177.2 | 0 | 0 | 0 | 0 | 112.9 | R15 V18 L19 Y64 Y66 G155 W156 | R15-V68 HydrophobicContact CB-CG1 4.04Å; R15-V68 HydrophobicContact CG-CG1 4.34Å; R15-V68 PolarHBondContact NE-O 2.78Å; R15-V68 PolarHBondContact NH2-O 3Å; V18-V68 HydrophobicContact CB-CG2 4.44Å; V18-V68 HydrophobicContact CG1-CG2 3.73Å; L19-V68 HydrophobicContact CD1-CG1 4.35Å; L19-V68 HydrophobicContact CD2-CB 3.9Å; L19-V68 HydrophobicContact CD2-CG1 3.84Å; L19-V68 HydrophobicContact CG-CB 4.37Å; L19-V68 HydrophobicContact CG-CG1 3.76Å; Y64-V68 VanDerWaalsContact O-CG2 3.29Å; Y64-V68 WeakPolarHBondContact O-CG2 3.4Å; Y64-V68 PolarHBondContact O-N 3.31Å; Y66-V68 PolarHBondContact O-N 3.4Å; V68-G155 WeakPolarHBondContact CA-O 2.98Å; V68-G155 PolarHBondContact N-O 3.37Å; V68-W156 HydrophobicContact CG2-CE3 3.81Å; V68-W156 HydrophobicContact CG2-CZ3 4.24Å |
| 69 | L | 90.8 | Very high | 90.1 | Very high | 88 Ų | 88 | 56.6 Ų | 56.6 | 46% | 0.461 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -72.7 | -26.9 | 175.6 | -79.2 | -178.9 | 0 | 0 | 0 | 113.4 | L19 F65 Y66 G67 | L19-L69 HydrophobicContact CD1-CD2 3.83Å; L19-L69 HydrophobicContact CD2-CD2 3.97Å; L19-L69 HydrophobicContact CD2-CG 3.82Å; F65-L69 HydrophobicContact CD1-CD1 3.68Å; F65-L69 HydrophobicContact CD1-CG 4.34Å; F65-L69 HydrophobicContact CE1-CD1 3.29Å; F65-L69 HydrophobicContact CE1-CG 4.14Å; F65-L69 HydrophobicContact CZ-CD1 4.02Å; F65-L69 WeakPolarHBondContact O-CG 3.23Å; F65-L69 PolarHBondContact O-N 3.08Å; Y66-L69 PolarHBondContact O-N 3.04Å; G67-L69 VanDerWaalsContact C-N 3.26Å; G67-L69 PolarHBondContact O-N 3.2Å |
| 70 | Q | 88.4 | Confident | 89.9 | Confident | 74 Ų | 74 | 55.9 Ų | 55.9 | 35% | 0.346 | 29% | 0.288 | S | S | . | . | S | Bend | trans | -89.5 | 145.2 | -178.2 | -65.1 | -56.3 | -33.4 | 0 | 0 | 111.2 | R15 Y66 G67 F72 | R15-Q70 PolarHBondContact NH2-O 2.9Å; Y66-Q70 HydrophobicContact CD1-CG 4.38Å; Y66-Q70 HydrophobicContact CD2-CG 4.3Å; Y66-Q70 HydrophobicContact CE1-CG 3.94Å; Y66-Q70 HydrophobicContact CE2-CG 3.83Å; Y66-Q70 WeakPolarHBondContact O-CG 3.16Å; Y66-Q70 PolarHBondContact O-N 2.75Å; G67-Q70 PolarHBondContact O-N 3.5Å; Q70-F72 HydrophobicContact CB-CD1 4.41Å; Q70-F72 HydrophobicContact CB-CD2 4.33Å; Q70-F72 HydrophobicContact CB-CE1 3.96Å; Q70-F72 HydrophobicContact CB-CE2 3.87Å; Q70-F72 HydrophobicContact CB-CZ 3.67Å; Q70-F72 HydrophobicContact CG-CE1 4.43Å; Q70-F72 HydrophobicContact CG-CZ 4.18Å |
| 71 | D | 84.3 | Confident | 89.8 | Confident | 111 Ų | 111 | 60.5 Ų | 60.5 | 59% | 0.594 | 31% | 0.312 | S | S | * | . | trans | -100 | 90.6 | 168.6 | -69.1 | -47.7 | 0 | 0 | 0 | 108 | R15 E73 | R15-D71 IonicContact CZ-OD1 3.16Å; R15-D71 IonicContact NH1-OD1 2.74Å; R15-D71 PolarHBondContact NH1-OD1 3.47Å; R15-D71 IonicContact NH1-OD2 3.92Å; R15-D71 IonicContact NH2-OD1 2.67Å; R15-D71 PolarHBondContact NH2-OD1 3.31Å; D71-E73 PolarHBondContact O-N 3.06Å | ||
| 72 | F | 82.4 | Confident | 89.8 | Confident | 23 Ų | 23 | 60.6 Ų | 60.6 | 10% | 0.101 | 31% | 0.313 | C | S | . | . | trans | -74.6 | 115 | 176.9 | -59.7 | -70.4 | 0 | 0 | 0 | 109.8 | Y66 Q70 D78 C79 Y147 | Y66-F72 HydrophobicContact CE1-CZ 4.39Å; Q70-F72 HydrophobicContact CB-CD1 4.41Å; Q70-F72 HydrophobicContact CB-CD2 4.33Å; Q70-F72 HydrophobicContact CB-CE1 3.96Å; Q70-F72 HydrophobicContact CB-CE2 3.87Å; Q70-F72 HydrophobicContact CB-CZ 3.67Å; Q70-F72 HydrophobicContact CG-CE1 4.43Å; Q70-F72 HydrophobicContact CG-CZ 4.18Å; F72-D78 WeakPolarHBondContact CE1-OD2 3.36Å; F72-C79 HydrophobicContact CD1-CB 3.65Å; F72-C79 HydrophobicContact CE1-CB 3.71Å; F72-C79 HydrophobicContact CG-CB 4.29Å; F72-C79 HydrophobicContact CZ-CB 4.39Å; F72-Y147 HydrophobicContact CB-CD2 3.73Å; F72-Y147 HydrophobicContact CB-CE2 3.7Å; F72-Y147 WeakPolarHBondContact O-CE2 3.49Å; F72-Y147 PolarHBondContact O-OH 3.05Å | ||
| 73 | E | 75.4 | Confident | 89.7 | Confident | 192 Ų | 192 | 58 Ų | 58 | 90% | 0.897 | 29% | 0.291 | S | S | * | . | trans | -90.9 | -5.5 | 177.1 | -61.8 | -173.7 | 164.6 | 0 | 0 | 112.9 | D71 | D71-E73 PolarHBondContact O-N 3.06Š| ||
| 74 | G | 75.3 | Confident | 89.7 | Confident | 20 Ų | 20 | 58.5 Ų | 58.5 | 21% | 0.206 | 30% | 0.296 | C | S | . | . | S | Bend | trans | 171.2 | -165.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | S76 | G74-S76 PolarHBondContact O-N 3.37Š|
| 75 | P | 79.9 | Confident | 89.8 | Confident | 125 Ų | 125 | 61 Ų | 61 | 81% | 0.812 | 31% | 0.309 | S | S | * | . | trans | -65.3 | 117 | 179.1 | -19 | 31.6 | 0 | 0 | 0 | 111.8 | ||||
| 76 | S | 89.4 | Confident | 89.8 | Confident | 36 Ų | 36 | 57.4 Ų | 57.4 | 25% | 0.252 | 29% | 0.294 | S | S | . | . | trans | -138.4 | 158.9 | -179.9 | 70.6 | 0 | 0 | 0 | 0 | 111.8 | G74 D78 C79 V80 | G74-S76 PolarHBondContact O-N 3.37Å; S76-D78 VanDerWaalsContact C-N 3.3Å; S76-D78 WeakPolarHBondContact CB-OD1 3.41Å; S76-D78 PolarHBondContact O-N 3.34Å; S76-D78 PolarHBondContact OG-OD1 2.89Å; S76-C79 WeakPolarHBondContact O-CB 3.06Å; S76-C79 PolarHBondContact O-N 3.09Å; S76-C79 WeakPolarHBondContact OG-CB 3.37Å; S76-C79 PolarHBondContact OG-N 2.96Å; S76-V80 WeakPolarHBondContact O-CG2 3.37Å; S76-V80 PolarHBondContact O-N 3.17Å; S76-V80 VanDerWaalsContact O-N 3.07Å | ||
| 77 | W | 91.1 | Very high | 89.9 | Confident | 195 Ų | 195 | 53.4 Ų | 53.4 | 74% | 0.739 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -66 | -34.6 | -176.7 | 72.9 | -92.2 | 0 | 0 | 0 | 112.2 | V80 L81 | W77-V80 PolarHBondContact O-N 3Å; W77-L81 HydrophobicContact CE3-CD2 4.38Å; W77-L81 HydrophobicContact CZ3-CD2 3.75Å; W77-L81 WeakPolarHBondContact O-CB 3.44Å; W77-L81 PolarHBondContact O-N 3.16Å |
| 78 | D | 92 | Very high | 90.3 | Very high | 28 Ų | 28 | 55.1 Ų | 55.1 | 15% | 0.15 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -72.8 | -35.6 | 178.4 | 59.1 | -44.7 | 0 | 0 | 0 | 111.6 | Y66 F72 S76 L81 Q82 | Y66-D78 HydrophobicContact CE1-CB 4.4Å; Y66-D78 PolarHBondContact OH-OD2 3.44Å; F72-D78 WeakPolarHBondContact CE1-OD2 3.36Å; S76-D78 VanDerWaalsContact C-N 3.3Å; S76-D78 WeakPolarHBondContact CB-OD1 3.41Å; S76-D78 PolarHBondContact O-N 3.34Å; S76-D78 PolarHBondContact OG-OD1 2.89Å; D78-L81 PolarHBondContact O-N 3.06Å; D78-Q82 WeakPolarHBondContact O-CB 3.41Å; D78-Q82 PolarHBondContact O-N 3.24Å |
| 79 | C | 91.2 | Very high | 90.6 | Very high | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.9 | -47.4 | 168.7 | 173.4 | 0 | 0 | 0 | 0 | 111.5 | F72 S76 Q82 G83 C157 | F72-C79 HydrophobicContact CD1-CB 3.65Å; F72-C79 HydrophobicContact CE1-CB 3.71Å; F72-C79 HydrophobicContact CG-CB 4.29Å; F72-C79 HydrophobicContact CZ-CB 4.39Å; S76-C79 WeakPolarHBondContact O-CB 3.06Å; S76-C79 PolarHBondContact O-N 3.09Å; S76-C79 WeakPolarHBondContact OG-CB 3.37Å; S76-C79 PolarHBondContact OG-N 2.96Å; C79-Q82 PolarHBondContact O-N 3.3Å; C79-G83 PolarHBondContact O-N 3.43Å; C79-C157 WeakPolarHBondContact CA-SG 3.32Å; C79-C157 HydrophobicContact CB-CB 4.07Å; C79-C157 WeakPolarHBondContact CB-SG 3.43Å; C79-C157 VanDerWaalsContact O-CB 3.23Å; C79-C157 WeakPolarHBondContact O-CB 3.5Å; C79-C157 WeakPolarHBondContact SG-CB 3.3Å; C79-C157 CovalentContact SG-SG 2.02Å; C79-C157 PolarHBondContact SG-SG 3.34Å |
| 80 | V | 93.8 | Very high | 90.8 | Very high | 43 Ų | 43 | 51.6 Ų | 51.6 | 26% | 0.261 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 176.9 | 175.7 | 0 | 0 | 0 | 0 | 111.3 | S76 W77 G83 A84 V140 I145 | S76-V80 WeakPolarHBondContact O-CG2 3.37Å; S76-V80 PolarHBondContact O-N 3.17Å; S76-V80 VanDerWaalsContact O-N 3.07Å; W77-V80 PolarHBondContact O-N 3Å; V80-G83 PolarHBondContact O-N 2.79Å; V80-A84 WeakPolarHBondContact O-CB 3.26Å; V80-A84 PolarHBondContact O-N 2.96Å; V80-V140 HydrophobicContact CG1-CG1 4.47Å; V80-I145 HydrophobicContact CG1-CG2 4.45Å |
| 81 | L | 95.3 | Very high | 91.2 | Very high | 101 Ų | 101 | 48.1 Ų | 48.1 | 53% | 0.529 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -63.6 | -45.5 | 177.6 | 178.6 | 61.7 | 0 | 0 | 0 | 111.5 | W77 D78 A84 L85 | W77-L81 HydrophobicContact CE3-CD2 4.38Å; W77-L81 HydrophobicContact CZ3-CD2 3.75Å; W77-L81 WeakPolarHBondContact O-CB 3.44Å; W77-L81 PolarHBondContact O-N 3.16Å; D78-L81 PolarHBondContact O-N 3.06Å; L81-A84 PolarHBondContact O-N 2.91Å; L81-L85 VanDerWaalsContact O-CB 3.3Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 PolarHBondContact O-N 2.95Å |
| 82 | Q | 95.7 | Very high | 91.9 | Very high | 4 Ų | 4 | 42.9 Ų | 42.9 | 2% | 0.019 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.2 | -49.9 | 176.6 | -176.3 | -76.4 | -55.8 | 0 | 0 | 110.5 | S63 Y66 D78 C79 A84 L85 S86 C157 | S63-Q82 WeakPolarHBondContact O-CG 3.41Å; S63-Q82 PolarHBondContact O-NE2 3.3Å; S63-Q82 PolarHBondContact OG-NE2 3.04Å; S63-Q82 PolarHBondContact OG-O 2.82Å; Y66-Q82 HydrophobicContact CD1-CB 4Å; Y66-Q82 HydrophobicContact CD1-CG 3.86Å; Y66-Q82 HydrophobicContact CE1-CB 4.31Å; D78-Q82 WeakPolarHBondContact O-CB 3.41Å; D78-Q82 PolarHBondContact O-N 3.24Å; C79-Q82 PolarHBondContact O-N 3.3Å; Q82-A84 VanDerWaalsContact C-N 3.33Å; Q82-A84 PolarHBondContact O-N 3.26Å; Q82-L85 PolarHBondContact O-N 3.03Å; Q82-S86 PolarHBondContact NE2-OG 3.22Å; Q82-S86 WeakPolarHBondContact O-CB 2.98Å; Q82-S86 PolarHBondContact O-N 3.42Å; Q82-S86 PolarHBondContact O-OG 2.89Å; Q82-C157 PolarHBondContact OE1-O 3.17Å |
| 83 | G | 94.6 | Very high | 92.5 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -59.8 | -40.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | C79 V80 S86 T87 C157 | C79-G83 PolarHBondContact O-N 3.43Å; V80-G83 PolarHBondContact O-N 2.79Å; G83-S86 WeakPolarHBondContact CA-OG 3.43Å; G83-S86 PolarHBondContact O-OG 3.44Å; G83-S86 VanDerWaalsContact O-OG 3.04Å; G83-T87 WeakPolarHBondContact O-CB 3.33Å; G83-T87 PolarHBondContact O-N 3.28Å; G83-T87 PolarHBondContact O-OG1 3.35Å; G83-C157 WeakPolarHBondContact CA-O 3.48Å |
| 84 | A | 96.5 | Very high | 93.5 | Very high | 15 Ų | 15 | 32.8 Ų | 32.8 | 12% | 0.124 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65.5 | -46 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V80 L81 Q82 T87 F88 T136 V140 I145 | V80-A84 WeakPolarHBondContact O-CB 3.26Å; V80-A84 PolarHBondContact O-N 2.96Å; L81-A84 PolarHBondContact O-N 2.91Å; Q82-A84 VanDerWaalsContact C-N 3.33Å; Q82-A84 PolarHBondContact O-N 3.26Å; A84-T87 PolarHBondContact O-N 3.47Å; A84-F88 WeakPolarHBondContact O-CB 3.5Å; A84-F88 PolarHBondContact O-N 2.92Å; A84-T136 HydrophobicContact CB-CG2 3.86Å; A84-T136 VanDerWaalsContact O-CG2 3.3Å; A84-T136 WeakPolarHBondContact O-CG2 3.27Å; A84-V140 HydrophobicContact CB-CG2 3.72Å; A84-I145 HydrophobicContact CB-CD1 4.08Å |
| 85 | L | 97.3 | Very high | 94.5 | Very high | 60 Ų | 60 | 33.1 Ų | 33.1 | 31% | 0.314 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -66.1 | -45 | -178.2 | -167.9 | 62 | 0 | 0 | 0 | 111.9 | L59 L81 Q82 A89 | L59-L85 HydrophobicContact CD1-CD1 3.78Å; L59-L85 HydrophobicContact CD1-CD2 3.87Å; L59-L85 HydrophobicContact CD1-CG 3.98Å; L59-L85 HydrophobicContact CD2-CD1 3.72Å; L59-L85 HydrophobicContact CD2-CG 4.43Å; L59-L85 HydrophobicContact CG-CD1 3.78Å; L59-L85 HydrophobicContact CG-CD2 4.4Å; L59-L85 HydrophobicContact CG-CG 3.98Å; L81-L85 VanDerWaalsContact O-CB 3.3Å; L81-L85 WeakPolarHBondContact O-CB 3.38Å; L81-L85 PolarHBondContact O-N 2.95Å; Q82-L85 PolarHBondContact O-N 3.03Å; L85-A89 WeakPolarHBondContact O-CB 3.48Å; L85-A89 PolarHBondContact O-N 3.39Å |
| 86 | S | 96 | Very high | 95.3 | Very high | 2 Ų | 2 | 27.2 Ų | 27.2 | 1% | 0.014 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -64.4 | -44.2 | 175.6 | 51.5 | 0 | 0 | 0 | 0 | 111.1 | S63 Q82 G83 A89 N90 | S63-S86 VanDerWaalsContact OG-CB 3.31Å; S63-S86 WeakPolarHBondContact OG-CB 3.47Å; S63-S86 PolarHBondContact OG-N 3.2Å; Q82-S86 PolarHBondContact NE2-OG 3.22Å; Q82-S86 WeakPolarHBondContact O-CB 2.98Å; Q82-S86 PolarHBondContact O-N 3.42Å; Q82-S86 PolarHBondContact O-OG 2.89Å; G83-S86 WeakPolarHBondContact CA-OG 3.43Å; G83-S86 PolarHBondContact O-OG 3.44Å; G83-S86 VanDerWaalsContact O-OG 3.04Å; S86-A89 PolarHBondContact O-N 3.15Å; S86-N90 WeakPolarHBondContact O-CB 3.37Å; S86-N90 PolarHBondContact O-N 3.45Å |
| 87 | T | 96.6 | Very high | 95.5 | Very high | 3 Ų | 3 | 25.5 Ų | 25.5 | 2% | 0.018 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -58.2 | -51.8 | 177 | -65.3 | 0 | 0 | 0 | 0 | 111.9 | G83 A84 T91 T173 | G83-T87 WeakPolarHBondContact O-CB 3.33Å; G83-T87 PolarHBondContact O-N 3.28Å; G83-T87 PolarHBondContact O-OG1 3.35Å; A84-T87 PolarHBondContact O-N 3.47Å; T87-T91 WeakPolarHBondContact O-CB 3.46Å; T87-T91 PolarHBondContact O-N 3.19Å; T87-T91 PolarHBondContact O-OG1 3.21Å; T87-T173 HydrophobicContact CG2-CG2 4.12Å |
| 88 | F | 98.4 | Very high | 95.7 | Very high | 37 Ų | 37 | 17.9 Ų | 17.9 | 16% | 0.162 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -59.5 | -55.2 | 178.4 | 166.4 | -111.5 | 0 | 0 | 0 | 111.1 | L59 A84 N90 T91 S92 W129 P132 L133 T136 | L59-F88 HydrophobicContact CD2-CD1 4.11Å; L59-F88 HydrophobicContact CD2-CE1 4.09Å; A84-F88 WeakPolarHBondContact O-CB 3.5Å; A84-F88 PolarHBondContact O-N 2.92Å; F88-N90 PolarHBondContact O-N 3.37Å; F88-T91 PolarHBondContact O-N 3.17Å; F88-S92 WeakPolarHBondContact O-CB 3.48Å; F88-S92 PolarHBondContact O-N 3.25Å; F88-S92 PolarHBondContact O-OG 3.49Å; F88-W129 HydrophobicContact CE1-CE3 4.23Å; F88-W129 HydrophobicContact CE1-CZ3 4.21Å; F88-W129 HydrophobicContact CE2-CE3 4.12Å; F88-W129 AromaticContact CZ-CE3 3.52Å; F88-W129 HydrophobicContact CZ-CE3 3.52Å; F88-W129 AromaticContact CZ-CZ3 3.96Å; F88-W129 HydrophobicContact CZ-CZ3 3.96Å; F88-P132 HydrophobicContact CD2-CB 3.92Å; F88-P132 HydrophobicContact CE2-CB 4.28Å; F88-L133 HydrophobicContact CD2-CB 4.13Å; F88-L133 HydrophobicContact CD2-CD1 4.39Å; F88-L133 HydrophobicContact CE2-CB 3.85Å; F88-L133 HydrophobicContact CE2-CD1 4.33Å; F88-T136 WeakPolarHBondContact CA-OG1 3.42Å; F88-T136 HydrophobicContact CB-CG2 4.16Å; F88-T136 PolarHBondContact N-OG1 3.28Å |
| 89 | A | 97.8 | Very high | 95.8 | Very high | 0 Ų | 0 | 16.8 Ų | 16.8 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -64.5 | -43.2 | -173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | L59 S60 L85 S86 S92 S93 | L59-A89 HydrophobicContact CB-CB 3.82Å; L59-A89 HydrophobicContact CD2-CB 3.93Å; L59-A89 HydrophobicContact CG-CB 3.83Å; S60-A89 WeakPolarHBondContact OG-CB 3.31Å; S60-A89 PolarHBondContact OG-O 2.86Å; L85-A89 WeakPolarHBondContact O-CB 3.48Å; L85-A89 PolarHBondContact O-N 3.39Å; S86-A89 PolarHBondContact O-N 3.15Å; A89-S92 PolarHBondContact O-N 2.7Å; A89-S93 PolarHBondContact O-N 2.9Å |
| 90 | N | 96.1 | Very high | 95.8 | Very high | 15 Ų | 15 | 17 Ų | 17 | 8% | 0.08 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -68.9 | -42.7 | -178.5 | -170.7 | 40.7 | 0 | 0 | 0 | 111.4 | S60 Y64 S86 F88 S93 F94 R238 | S60-N90 WeakPolarHBondContact OG-CA 3.32Å; S60-N90 PolarHBondContact OG-N 3.07Å; S60-N90 VanDerWaalsContact OG-N 3.16Å; Y64-N90 PolarHBondContact OH-ND2 3.4Å; S86-N90 WeakPolarHBondContact O-CB 3.37Å; S86-N90 PolarHBondContact O-N 3.45Å; F88-N90 PolarHBondContact O-N 3.37Å; N90-S93 WeakPolarHBondContact O-CB 3.28Å; N90-S93 PolarHBondContact O-N 3.38Å; N90-F94 WeakPolarHBondContact O-CG 3.03Å; N90-F94 PolarHBondContact O-N 3.44Å; N90-R238 VanDerWaalsContact OD1-CZ 3.27Å; N90-R238 PolarHBondContact OD1-NH1 3.16Å; N90-R238 PolarHBondContact OD1-NH2 3.17Å |
| 91 | T | 96.8 | Very high | 95.6 | Very high | 1 Ų | 1 | 15.4 Ų | 15.4 | 1% | 0.006 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -64.5 | -43.8 | 175.2 | -54.4 | 0 | 0 | 0 | 0 | 110.3 | T87 F88 S93 F94 F95 P132 T173 W177 | T87-T91 WeakPolarHBondContact O-CB 3.46Å; T87-T91 PolarHBondContact O-N 3.19Å; T87-T91 PolarHBondContact O-OG1 3.21Å; F88-T91 PolarHBondContact O-N 3.17Å; T91-S93 VanDerWaalsContact C-N 3.28Å; T91-S93 PolarHBondContact O-N 3.48Å; T91-F94 VanDerWaalsContact O-CB 3.26Å; T91-F94 WeakPolarHBondContact O-CB 3.43Å; T91-F94 PolarHBondContact O-N 3.38Å; T91-F95 HydrophobicContact CG2-CD2 3.99Å; T91-F95 HydrophobicContact CG2-CE2 3.74Å; T91-F95 WeakPolarHBondContact O-CD2 3.13Å; T91-F95 PolarHBondContact O-N 3.38Å; T91-F95 VanDerWaalsContact O-N 3.16Å; T91-P132 HydrophobicContact CG2-CB 4.06Å; T91-P132 HydrophobicContact CG2-CG 3.91Å; T91-T173 PolarHBondContact OG1-O 3.26Å; T91-W177 HydrophobicContact CG2-CG 4.28Å |
| 92 | S | 98.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -56.6 | -39.3 | 172.5 | -77 | 0 | 0 | 0 | 0 | 113.2 | F88 A89 F94 F95 W96 S128 W129 P132 | F88-S92 WeakPolarHBondContact O-CB 3.48Å; F88-S92 PolarHBondContact O-N 3.25Å; F88-S92 PolarHBondContact O-OG 3.49Å; A89-S92 PolarHBondContact O-N 2.7Å; S92-F94 VanDerWaalsContact C-N 3.31Å; S92-F94 PolarHBondContact O-N 2.9Å; S92-F95 PolarHBondContact O-N 3.2Å; S92-W96 WeakPolarHBondContact O-CB 3.22Å; S92-W96 PolarHBondContact O-N 3.5Å; S92-S128 WeakPolarHBondContact CA-O 3.37Å; S92-S128 VanDerWaalsContact CB-O 3.26Å; S92-S128 WeakPolarHBondContact CB-O 3.33Å; S92-S128 PolarHBondContact OG-O 2.68Å; S92-W129 VanDerWaalsContact OG-CE3 3.28Å; S92-P132 WeakPolarHBondContact OG-CB 3.5Å; S92-P132 WeakPolarHBondContact OG-CG 3.42Å |
| 93 | S | 96.2 | Very high | 95.1 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -59.5 | -39.8 | 174.4 | 178.5 | 0 | 0 | 0 | 0 | 112.1 | L53 D57 A89 N90 T91 W96 T97 | L53-S93 WeakPolarHBondContact CD1-O 3.42Å; L53-S93 WeakPolarHBondContact CD1-OG 3.15Å; D57-S93 WeakPolarHBondContact OD1-CB 3.41Å; D57-S93 PolarHBondContact OD1-OG 2.95Å; A89-S93 PolarHBondContact O-N 2.9Å; N90-S93 WeakPolarHBondContact O-CB 3.28Å; N90-S93 PolarHBondContact O-N 3.38Å; T91-S93 VanDerWaalsContact C-N 3.28Å; T91-S93 PolarHBondContact O-N 3.48Å; S93-W96 PolarHBondContact O-N 2.86Å; S93-T97 WeakPolarHBondContact O-CB 3.3Å; S93-T97 PolarHBondContact O-N 3.36Å; S93-T97 PolarHBondContact O-OG1 3.17Å |
| 94 | F | 95.6 | Very high | 94.6 | Very high | 4 Ų | 4 | 15.9 Ų | 15.9 | 2% | 0.018 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -59.1 | -52.1 | 173.3 | -57.9 | -32.8 | 0 | 0 | 0 | 112.4 | N90 T91 S92 W96 T97 V98 W177 E178 F234 R238 | N90-F94 WeakPolarHBondContact O-CG 3.03Å; N90-F94 PolarHBondContact O-N 3.44Å; T91-F94 VanDerWaalsContact O-CB 3.26Å; T91-F94 WeakPolarHBondContact O-CB 3.43Å; T91-F94 PolarHBondContact O-N 3.38Å; S92-F94 VanDerWaalsContact C-N 3.31Å; S92-F94 PolarHBondContact O-N 2.9Å; F94-W96 PolarHBondContact O-N 3.35Å; F94-T97 WeakPolarHBondContact O-CB 3.46Å; F94-T97 PolarHBondContact O-N 2.93Å; F94-V98 WeakPolarHBondContact O-CG2 3.41Å; F94-V98 PolarHBondContact O-N 2.86Å; F94-W177 HydrophobicContact CD2-CB 4.14Å; F94-E178 HydrophobicContact CE1-CB 4.46Å; F94-E178 HydrophobicContact CE2-CB 4.02Å; F94-E178 HydrophobicContact CZ-CB 3.91Å; F94-E178 HydrophobicContact CZ-CG 4.29Å; F94-F234 AromaticContact CD1-CE2 3.44Å; F94-F234 HydrophobicContact CD1-CE2 3.44Å; F94-F234 VanDerWaalsContact CD1-CE2 3.44Å; F94-F234 AromaticContact CD1-CZ 3.33Å; F94-F234 HydrophobicContact CD1-CZ 3.33Å; F94-F234 AromaticContact CE1-CE2 3.69Å; F94-F234 HydrophobicContact CE1-CE2 3.69Å; F94-F234 AromaticContact CE1-CZ 3.51Å; F94-F234 HydrophobicContact CE1-CZ 3.51Å; F94-F234 HydrophobicContact CG-CZ 4.35Å; F94-R238 HydrophobicContact CE1-CG 4.33Å |
| 95 | F | 96.9 | Very high | 94.1 | Very high | 27 Ų | 27 | 16.5 Ų | 16.5 | 12% | 0.118 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -63.6 | -42 | -179 | -81 | -93 | 0 | 0 | 0 | 112 | T91 S92 T97 V98 A99 V127 I131 P132 W177 | T91-F95 HydrophobicContact CG2-CD2 3.99Å; T91-F95 HydrophobicContact CG2-CE2 3.74Å; T91-F95 WeakPolarHBondContact O-CD2 3.13Å; T91-F95 PolarHBondContact O-N 3.38Å; T91-F95 VanDerWaalsContact O-N 3.16Å; S92-F95 PolarHBondContact O-N 3.2Å; F95-T97 VanDerWaalsContact C-N 3.33Å; F95-T97 PolarHBondContact O-N 3Å; F95-V98 PolarHBondContact O-N 2.92Å; F95-A99 WeakPolarHBondContact O-CB 3.38Å; F95-A99 PolarHBondContact O-N 3.15Å; F95-V127 HydrophobicContact CD1-CG1 3.56Å; F95-V127 HydrophobicContact CE1-CG1 3.87Å; F95-I131 HydrophobicContact CE1-CB 4.44Å; F95-I131 HydrophobicContact CE1-CD1 4.08Å; F95-I131 HydrophobicContact CE1-CG2 4.35Å; F95-I131 HydrophobicContact CE2-CG2 4.36Å; F95-I131 HydrophobicContact CZ-CB 4.21Å; F95-I131 HydrophobicContact CZ-CD1 4.46Å; F95-I131 HydrophobicContact CZ-CG2 3.74Å; F95-P132 HydrophobicContact CD2-CG 3.82Å; F95-P132 HydrophobicContact CE2-CG 4.12Å; F95-W177 HydrophobicContact CE1-CE3 4.08Å; F95-W177 HydrophobicContact CE1-CZ3 4.06Å; F95-W177 HydrophobicContact CE2-CB 4.33Å; F95-W177 AromaticContact CE2-CD2 3.63Å; F95-W177 HydrophobicContact CE2-CD2 3.63Å; F95-W177 AromaticContact CE2-CE3 3.81Å; F95-W177 HydrophobicContact CE2-CE3 3.81Å; F95-W177 AromaticContact CE2-CG 3.86Å; F95-W177 HydrophobicContact CE2-CG 3.86Å; F95-W177 HydrophobicContact CE2-CZ3 4.39Å; F95-W177 AromaticContact CZ-CD2 3.55Å; F95-W177 HydrophobicContact CZ-CD2 3.55Å; F95-W177 AromaticContact CZ-CE2 3.93Å; F95-W177 AromaticContact CZ-CE3 3.29Å; F95-W177 HydrophobicContact CZ-CE3 3.29Å; F95-W177 HydrophobicContact CZ-CG 4.27Å; F95-W177 AromaticContact CZ-CH2 3.86Å; F95-W177 HydrophobicContact CZ-CH2 3.86Å; F95-W177 HydrophobicContact CZ-CZ2 4.09Å; F95-W177 AromaticContact CZ-CZ3 3.47Å; F95-W177 HydrophobicContact CZ-CZ3 3.47Å; F95-W177 VanDerWaalsContact CZ-CZ3 3.47Å |
| 96 | W | 96.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 14.5 Ų | 14.5 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -63.2 | -38.4 | 175.7 | -81.9 | 117.3 | 0 | 0 | 0 | 112.7 | L49 F52 L53 S92 S93 F94 A99 I100 F124 H125 S128 W129 | L49-W96 HydrophobicContact CD2-CE3 4.24Å; L49-W96 HydrophobicContact CD2-CZ3 3.55Å; F52-W96 HydrophobicContact CB-CD2 3.78Å; F52-W96 VanDerWaalsContact CB-CE2 3.46Å; F52-W96 HydrophobicContact CB-CE3 4.12Å; F52-W96 HydrophobicContact CB-CG 4.42Å; F52-W96 HydrophobicContact CB-CH2 3.95Å; F52-W96 HydrophobicContact CB-CZ2 3.58Å; F52-W96 HydrophobicContact CB-CZ3 4.21Å; F52-W96 AromaticContact CD2-CH2 3.72Å; F52-W96 HydrophobicContact CD2-CH2 3.72Å; F52-W96 HydrophobicContact CD2-CZ2 4.09Å; F52-W96 HydrophobicContact CD2-CZ3 4.09Å; F52-W96 HydrophobicContact CG-CH2 4.04Å; F52-W96 AromaticContact CG-CZ2 3.92Å; F52-W96 HydrophobicContact CG-CZ2 3.92Å; L53-W96 HydrophobicContact CB-CB 3.99Å; L53-W96 HydrophobicContact CD1-CB 3.91Å; S92-W96 WeakPolarHBondContact O-CB 3.22Å; S92-W96 PolarHBondContact O-N 3.5Å; S93-W96 PolarHBondContact O-N 2.86Å; F94-W96 PolarHBondContact O-N 3.35Å; W96-A99 HydrophobicContact CE3-CB 4.28Å; W96-A99 PolarHBondContact O-N 2.78Å; W96-I100 VanDerWaalsContact O-CG1 3.31Å; W96-I100 WeakPolarHBondContact O-CG1 3.43Å; W96-I100 PolarHBondContact O-N 2.91Å; W96-F124 HydrophobicContact CH2-CB 4.19Å; W96-F124 HydrophobicContact CZ3-CB 3.91Å; W96-H125 AromaticContact CH2-CE1 3.78Å; W96-H125 AromaticContact CH2-CG 4Å; W96-H125 AromaticContact CH2-ND1 3.71Å; W96-H125 AromaticContact CZ2-CE1 3.97Å; W96-H125 AromaticContact CZ2-ND1 3.68Å; W96-S128 VanDerWaalsContact CE2-CB 3.43Å; W96-W129 AromaticContact CE2-CE2 3.82Å; W96-W129 AromaticContact CE2-NE1 3.7Å; W96-W129 AromaticContact CZ2-CD1 3.69Å; W96-W129 AromaticContact CZ2-CE2 3.88Å; W96-W129 HydrophobicContact CZ2-CZ2 4.43Å; W96-W129 AromaticContact CZ2-NE1 3.26Å; W96-W129 VanDerWaalsContact CZ2-NE1 3.26Å; W96-W129 AromaticContact NE1-CD2 3.69Å; W96-W129 AromaticContact NE1-CE2 3.2Å; W96-W129 AromaticContact NE1-CH2 3.83Å; W96-W129 AromaticContact NE1-CZ2 3.28Å; W96-W129 VanDerWaalsContact NE1-CZ2 3.28Å; W96-W129 AromaticContact NE1-NE1 3.56Å |
| 97 | T | 94.1 | Very high | 92.9 | Very high | 1 Ų | 1 | 16.6 Ų | 16.6 | 1% | 0.006 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -61.5 | -46.5 | 175.7 | -60.5 | 0 | 0 | 0 | 0 | 111 | S93 F94 F95 I100 A101 L185 I230 F234 | S93-T97 WeakPolarHBondContact O-CB 3.3Å; S93-T97 PolarHBondContact O-N 3.36Å; S93-T97 PolarHBondContact O-OG1 3.17Å; F94-T97 WeakPolarHBondContact O-CB 3.46Å; F94-T97 PolarHBondContact O-N 2.93Å; F95-T97 VanDerWaalsContact C-N 3.33Å; F95-T97 PolarHBondContact O-N 3Å; T97-I100 PolarHBondContact O-N 3.46Å; T97-A101 PolarHBondContact O-N 3.36Å; T97-A101 VanDerWaalsContact O-N 3.14Å; T97-L185 HydrophobicContact CG2-CD1 3.87Å; T97-L185 HydrophobicContact CG2-CD2 4.17Å; T97-I230 HydrophobicContact CG2-CG2 3.91Å; T97-F234 HydrophobicContact CG2-CB 4.29Å; T97-F234 HydrophobicContact CG2-CD2 4.02Å; T97-F234 HydrophobicContact CG2-CG 4.1Å |
| 98 | V | 94.2 | Very high | 92 | Very high | 34 Ų | 34 | 17.7 Ų | 17.7 | 21% | 0.206 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -64.7 | -41.1 | 175.2 | 176.6 | 0 | 0 | 0 | 0 | 111.3 | F94 F95 I100 A101 F102 A181 L184 L185 | F94-V98 WeakPolarHBondContact O-CG2 3.41Å; F94-V98 PolarHBondContact O-N 2.86Å; F95-V98 PolarHBondContact O-N 2.92Å; V98-I100 PolarHBondContact O-N 3.22Å; V98-A101 PolarHBondContact O-N 3.24Å; V98-F102 WeakPolarHBondContact O-CB 3.37Å; V98-F102 PolarHBondContact O-N 3.01Å; V98-A181 HydrophobicContact CG2-CB 3.95Å; V98-L184 HydrophobicContact CG1-CD1 4.25Å; V98-L185 HydrophobicContact CB-CD2 4.44Å; V98-L185 HydrophobicContact CG2-CD2 3.99Å; V98-L185 HydrophobicContact CG2-CG 4.28Å |
| 99 | A | 93.9 | Very high | 91.2 | Very high | 6 Ų | 6 | 17.5 Ų | 17.5 | 5% | 0.05 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -61.1 | -41.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F95 W96 F102 Y103 F124 | F95-A99 WeakPolarHBondContact O-CB 3.38Å; F95-A99 PolarHBondContact O-N 3.15Å; W96-A99 HydrophobicContact CE3-CB 4.28Å; W96-A99 PolarHBondContact O-N 2.78Å; A99-F102 PolarHBondContact O-N 3.46Å; A99-Y103 VanDerWaalsContact O-CB 3.26Å; A99-Y103 WeakPolarHBondContact O-CB 3.28Å; A99-Y103 PolarHBondContact O-N 2.88Å; A99-F124 HydrophobicContact CB-CB 4.31Å; A99-F124 HydrophobicContact CB-CD1 3.78Å; A99-F124 HydrophobicContact CB-CD2 4.4Å; A99-F124 HydrophobicContact CB-CE1 4.13Å; A99-F124 HydrophobicContact CB-CG 3.93Å |
| 100 | I | 90.7 | Very high | 90.2 | Very high | 3 Ų | 3 | 23.3 Ų | 23.3 | 2% | 0.015 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -61.6 | -48.8 | 174.3 | -71.1 | 164.6 | 0 | 0 | 0 | 110.6 | L49 L53 W96 T97 V98 F102 Y103 L104 L227 I230 | L49-I100 HydrophobicContact CB-CD1 4.3Å; L49-I100 HydrophobicContact CB-CG1 3.6Å; L49-I100 HydrophobicContact CD1-CG1 4.35Å; L53-I100 HydrophobicContact CB-CD1 4.06Å; L53-I100 HydrophobicContact CD2-CD1 3.68Å; W96-I100 VanDerWaalsContact O-CG1 3.31Å; W96-I100 WeakPolarHBondContact O-CG1 3.43Å; W96-I100 PolarHBondContact O-N 2.91Å; T97-I100 PolarHBondContact O-N 3.46Å; V98-I100 PolarHBondContact O-N 3.22Å; I100-F102 VanDerWaalsContact C-N 3.31Å; I100-F102 PolarHBondContact O-N 3.03Å; I100-Y103 PolarHBondContact O-N 2.92Å; I100-L104 HydrophobicContact CG2-CD1 3.91Å; I100-L104 WeakPolarHBondContact O-CD1 3.25Å; I100-L104 VanDerWaalsContact O-CG 3.29Å; I100-L104 WeakPolarHBondContact O-CG 3.26Å; I100-L104 PolarHBondContact O-N 3.42Å; I100-L227 HydrophobicContact CG2-CD2 4.09Å; I100-I230 HydrophobicContact CG2-CD1 4.23Å |
| 101 | A | 90.1 | Very high | 88.8 | Confident | 11 Ų | 11 | 25 Ų | 25 | 9% | 0.091 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -60.5 | -42.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | T97 V98 L104 Y105 L185 L188 | T97-A101 PolarHBondContact O-N 3.36Å; T97-A101 VanDerWaalsContact O-N 3.14Å; V98-A101 PolarHBondContact O-N 3.24Å; A101-L104 PolarHBondContact O-N 3.28Å; A101-Y105 PolarHBondContact O-N 3.39Å; A101-L185 HydrophobicContact CB-CD2 3.55Å; A101-L188 HydrophobicContact CB-CD1 3.96Å |
| 102 | F | 91.3 | Very high | 86.8 | Confident | 74 Ų | 74 | 30.5 Ų | 30.5 | 33% | 0.325 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -68.3 | -41.9 | 178.1 | -173.5 | -114 | 0 | 0 | 0 | 112.2 | V98 A99 I100 L104 Y105 L106 F124 L188 | V98-F102 WeakPolarHBondContact O-CB 3.37Å; V98-F102 PolarHBondContact O-N 3.01Å; A99-F102 PolarHBondContact O-N 3.46Å; I100-F102 VanDerWaalsContact C-N 3.31Å; I100-F102 PolarHBondContact O-N 3.03Å; F102-L104 VanDerWaalsContact C-N 3.28Å; F102-L104 PolarHBondContact O-N 3.46Å; F102-Y105 HydrophobicContact CD2-CD1 4.29Å; F102-Y105 HydrophobicContact CE2-CD1 4.25Å; F102-Y105 WeakPolarHBondContact O-CB 3.39Å; F102-Y105 PolarHBondContact O-N 3.23Å; F102-L106 HydrophobicContact CD1-CD1 3.91Å; F102-L106 HydrophobicContact CD1-CG 4.36Å; F102-L106 HydrophobicContact CE1-CD1 3.47Å; F102-L106 VanDerWaalsContact CE1-CD1 3.47Å; F102-L106 HydrophobicContact CE1-CD2 4.49Å; F102-L106 HydrophobicContact CE1-CG 4.06Å; F102-L106 HydrophobicContact CE2-CD2 4.36Å; F102-L106 HydrophobicContact CE2-CG 4.38Å; F102-L106 HydrophobicContact CZ-CD1 3.88Å; F102-L106 HydrophobicContact CZ-CD2 4.05Å; F102-L106 HydrophobicContact CZ-CG 4.06Å; F102-L106 WeakPolarHBondContact O-CG 3.29Å; F102-L106 PolarHBondContact O-N 2.85Å; F102-F124 AromaticContact CD1-CE1 3.84Å; F102-F124 HydrophobicContact CD1-CE1 3.84Å; F102-F124 AromaticContact CD1-CZ 3.91Å; F102-F124 HydrophobicContact CD1-CZ 3.91Å; F102-L188 HydrophobicContact CB-CD1 4.2Å; F102-L188 HydrophobicContact CD2-CD2 4.16Å |
| 103 | Y | 88.7 | Confident | 84.8 | Confident | 30 Ų | 30 | 40.7 Ų | 40.7 | 12% | 0.118 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -56.7 | -42.7 | 173.7 | 175.1 | -95.2 | 0 | 0 | 0 | 111.7 | R45 A46 L49 A99 I100 L106 S107 L120 F124 | R45-Y103 HydrophobicContact CB-CE2 4.37Å; R45-Y103 WeakPolarHBondContact CB-OH 3.43Å; A46-Y103 HydrophobicContact CB-CD1 4.38Å; A46-Y103 HydrophobicContact CB-CE1 3.97Å; L49-Y103 HydrophobicContact CD1-CD1 3.89Å; L49-Y103 HydrophobicContact CD1-CD2 4Å; L49-Y103 HydrophobicContact CD1-CG 3.52Å; A99-Y103 VanDerWaalsContact O-CB 3.26Å; A99-Y103 WeakPolarHBondContact O-CB 3.28Å; A99-Y103 PolarHBondContact O-N 2.88Å; I100-Y103 PolarHBondContact O-N 2.92Å; Y103-L106 PolarHBondContact O-N 3.33Å; Y103-S107 WeakPolarHBondContact CE1-OG 3.29Å; Y103-S107 VanDerWaalsContact O-CB 3.29Å; Y103-S107 WeakPolarHBondContact O-CB 3.31Å; Y103-S107 PolarHBondContact O-N 3.3Å; Y103-S107 PolarHBondContact O-OG 3.21Å; Y103-L120 HydrophobicContact CD2-CD2 4.46Å; Y103-F124 HydrophobicContact CD2-CE2 4.16Å; Y103-F124 HydrophobicContact CG-CE2 4.48Å |
| 104 | L | 84.2 | Confident | 82.6 | Confident | 10 Ų | 10 | 43.5 Ų | 43.5 | 5% | 0.052 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -67.4 | -43.1 | 177.7 | -69 | 161.5 | 0 | 0 | 0 | 111.9 | I100 A101 F102 L106 S107 I108 L227 | I100-L104 HydrophobicContact CG2-CD1 3.91Å; I100-L104 WeakPolarHBondContact O-CD1 3.25Å; I100-L104 VanDerWaalsContact O-CG 3.29Å; I100-L104 WeakPolarHBondContact O-CG 3.26Å; I100-L104 PolarHBondContact O-N 3.42Å; A101-L104 PolarHBondContact O-N 3.28Å; F102-L104 VanDerWaalsContact C-N 3.28Å; F102-L104 PolarHBondContact O-N 3.46Å; L104-L106 VanDerWaalsContact C-N 3.33Å; L104-L106 PolarHBondContact O-N 2.87Å; L104-S107 PolarHBondContact O-N 3.02Å; L104-I108 HydrophobicContact CB-CD1 4.43Å; L104-I108 VanDerWaalsContact O-CB 3.3Å; L104-I108 WeakPolarHBondContact O-CB 3.39Å; L104-I108 VanDerWaalsContact O-CG1 3.25Å; L104-I108 WeakPolarHBondContact O-CG1 3.47Å; L104-I108 PolarHBondContact O-N 3.18Å; L104-L227 HydrophobicContact CD1-CB 3.3Å; L104-L227 HydrophobicContact CD1-CD1 3.92Å; L104-L227 HydrophobicContact CD1-CG 4.14Å; L104-L227 HydrophobicContact CD2-CB 4.31Å; L104-L227 HydrophobicContact CD2-CD1 3.58Å; L104-L227 HydrophobicContact CG-CB 4.41Å; L104-L227 HydrophobicContact CG-CD1 4.25Å |
| 105 | Y | 86.6 | Confident | 80.5 | Confident | 29 Ų | 29 | 45.6 Ų | 45.6 | 11% | 0.114 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -55.9 | -48.6 | 173.4 | 167.4 | -100.2 | 0 | 0 | 0 | 111.5 | A101 F102 V109 R110 L188 L191 V192 | A101-Y105 PolarHBondContact O-N 3.39Å; F102-Y105 HydrophobicContact CD2-CD1 4.29Å; F102-Y105 HydrophobicContact CE2-CD1 4.25Å; F102-Y105 WeakPolarHBondContact O-CB 3.39Å; F102-Y105 PolarHBondContact O-N 3.23Å; Y105-V109 HydrophobicContact CD2-CB 3.94Å; Y105-V109 HydrophobicContact CD2-CG1 4.47Å; Y105-V109 HydrophobicContact CD2-CG2 3.6Å; Y105-V109 HydrophobicContact CE2-CB 3.73Å; Y105-V109 HydrophobicContact CE2-CG1 3.79Å; Y105-V109 HydrophobicContact CE2-CG2 3.76Å; Y105-V109 WeakPolarHBondContact O-CA 3.39Å; Y105-V109 VanDerWaalsContact O-CB 3.24Å; Y105-V109 WeakPolarHBondContact O-CB 3.39Å; Y105-V109 WeakPolarHBondContact O-CG2 3.38Å; Y105-V109 PolarHBondContact O-N 3.06Å; Y105-R110 HydrophobicContact CE1-CG 4.39Å; Y105-R110 PolarHBondContact OH-NE 2.61Å; Y105-R110 PolarHBondContact OH-NH2 2.85Å; Y105-L188 HydrophobicContact CD1-CD2 4.14Å; Y105-L188 HydrophobicContact CD2-CD2 4.39Å; Y105-L188 HydrophobicContact CG-CD2 3.88Å; Y105-L191 HydrophobicContact CD2-CB 3.96Å; Y105-L191 HydrophobicContact CD2-CD1 4.38Å; Y105-L191 HydrophobicContact CE2-CB 3.83Å; Y105-L191 HydrophobicContact CE2-CD1 3.91Å; Y105-L191 HydrophobicContact CE2-CG 4.47Å; Y105-V192 HydrophobicContact CD2-CG2 4.22Å |
| 106 | L | 86.9 | Confident | 78.8 | Confident | 17 Ų | 17 | 54.2 Ų | 54.2 | 9% | 0.089 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.2 | -45 | 177.9 | -67.6 | -179.7 | 0 | 0 | 0 | 112.1 | F102 Y103 L104 I108 R110 A111 L120 | F102-L106 HydrophobicContact CD1-CD1 3.91Å; F102-L106 HydrophobicContact CD1-CG 4.36Å; F102-L106 HydrophobicContact CE1-CD1 3.47Å; F102-L106 VanDerWaalsContact CE1-CD1 3.47Å; F102-L106 HydrophobicContact CE1-CD2 4.49Å; F102-L106 HydrophobicContact CE1-CG 4.06Å; F102-L106 HydrophobicContact CE2-CD2 4.36Å; F102-L106 HydrophobicContact CE2-CG 4.38Å; F102-L106 HydrophobicContact CZ-CD1 3.88Å; F102-L106 HydrophobicContact CZ-CD2 4.05Å; F102-L106 HydrophobicContact CZ-CG 4.06Å; F102-L106 WeakPolarHBondContact O-CG 3.29Å; F102-L106 PolarHBondContact O-N 2.85Å; Y103-L106 PolarHBondContact O-N 3.33Å; L104-L106 VanDerWaalsContact C-N 3.33Å; L104-L106 PolarHBondContact O-N 2.87Å; L106-I108 VanDerWaalsContact C-N 3.33Å; L106-I108 PolarHBondContact O-N 3.02Å; L106-R110 HydrophobicContact CD2-CB 4.44Å; L106-R110 HydrophobicContact CD2-CG 4.3Å; L106-R110 CarbonylContact O-C 3.59Å; L106-R110 VanDerWaalsContact O-C 3.31Å; L106-R110 WeakPolarHBondContact O-CA 3.34Å; L106-R110 WeakPolarHBondContact O-CB 3.21Å; L106-R110 PolarHBondContact O-N 3.22Å; L106-A111 PolarHBondContact O-N 3.36Å; L106-L120 HydrophobicContact CD1-CD1 4.23Å; L106-L120 HydrophobicContact CD1-CD2 3.66Å |
| 107 | S | 80.6 | Confident | 77.5 | Confident | 46 Ų | 46 | 55.6 Ų | 55.6 | 32% | 0.322 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67.2 | -33.3 | -176.9 | -59.2 | 0 | 0 | 0 | 0 | 112.9 | Y103 L104 | Y103-S107 WeakPolarHBondContact CE1-OG 3.29Å; Y103-S107 VanDerWaalsContact O-CB 3.29Å; Y103-S107 WeakPolarHBondContact O-CB 3.31Å; Y103-S107 PolarHBondContact O-N 3.3Å; Y103-S107 PolarHBondContact O-OG 3.21Å; L104-S107 PolarHBondContact O-N 3.02Å |
| 108 | I | 79.1 | Confident | 76.5 | Confident | 26 Ų | 26 | 61.3 Ų | 61.3 | 13% | 0.133 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -91.4 | -52 | -177.3 | -63.2 | 168.9 | 0 | 0 | 0 | 111 | L104 L106 V192 H195 I196 | L104-I108 HydrophobicContact CB-CD1 4.43Å; L104-I108 VanDerWaalsContact O-CB 3.3Å; L104-I108 WeakPolarHBondContact O-CB 3.39Å; L104-I108 VanDerWaalsContact O-CG1 3.25Å; L104-I108 WeakPolarHBondContact O-CG1 3.47Å; L104-I108 PolarHBondContact O-N 3.18Å; L106-I108 VanDerWaalsContact C-N 3.33Å; L106-I108 PolarHBondContact O-N 3.02Å; I108-V192 HydrophobicContact CD1-CG1 3.74Å; I108-V192 HydrophobicContact CG2-CG1 4.33Å; I108-H195 PolarHBondContact O-NE2 3.4Å; I108-I196 HydrophobicContact CG2-CD1 4.42Å; I108-I196 HydrophobicContact CG2-CG1 4.06Å |
| 109 | V | 81.4 | Confident | 76 | Confident | 34 Ų | 34 | 65.8 Ų | 65.8 | 21% | 0.206 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -87.7 | -31.7 | -169.6 | -174.4 | 0 | 0 | 0 | 0 | 112.1 | Y105 V192 H195 | Y105-V109 HydrophobicContact CD2-CB 3.94Å; Y105-V109 HydrophobicContact CD2-CG1 4.47Å; Y105-V109 HydrophobicContact CD2-CG2 3.6Å; Y105-V109 HydrophobicContact CE2-CB 3.73Å; Y105-V109 HydrophobicContact CE2-CG1 3.79Å; Y105-V109 HydrophobicContact CE2-CG2 3.76Å; Y105-V109 WeakPolarHBondContact O-CA 3.39Å; Y105-V109 VanDerWaalsContact O-CB 3.24Å; Y105-V109 WeakPolarHBondContact O-CB 3.39Å; Y105-V109 WeakPolarHBondContact O-CG2 3.38Å; Y105-V109 PolarHBondContact O-N 3.06Å; V109-V192 HydrophobicContact CG2-CG2 4.21Å; V109-H195 HydrophobicContact CB-CB 4.42Å; V109-H195 HydrophobicContact CG1-CB 4.2Å; V109-H195 HydrophobicContact CG2-CB 3.71Å |
| 110 | R | 76.8 | Confident | 75.7 | Confident | 121 Ų | 121 | 67 Ų | 67 | 46% | 0.457 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -109.8 | 24.2 | -176.8 | -58.5 | -164.1 | -177.1 | 170.5 | -3.9 | 113.2 | Y105 L106 S112 R113 | Y105-R110 HydrophobicContact CE1-CG 4.39Å; Y105-R110 PolarHBondContact OH-NE 2.61Å; Y105-R110 PolarHBondContact OH-NH2 2.85Å; L106-R110 HydrophobicContact CD2-CB 4.44Å; L106-R110 HydrophobicContact CD2-CG 4.3Å; L106-R110 CarbonylContact O-C 3.59Å; L106-R110 VanDerWaalsContact O-C 3.31Å; L106-R110 WeakPolarHBondContact O-CA 3.34Å; L106-R110 WeakPolarHBondContact O-CB 3.21Å; L106-R110 PolarHBondContact O-N 3.22Å; R110-S112 PolarHBondContact O-N 3.1Å; R110-R113 PolarHBondContact O-N 3.49Å |
| 111 | A | 67.2 | Low | 75.6 | Confident | 51 Ų | 51 | 67.8 Ų | 67.8 | 42% | 0.421 | 35% | 0.349 | S | S | . | . | G | 310 helix | trans | -54.7 | -25.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | L106 | L106-A111 PolarHBondContact O-N 3.36Š|
| 112 | S | 54.9 | Low | 75.7 | Confident | 116 Ų | 116 | 75.7 Ų | 75.7 | 81% | 0.811 | 38% | 0.377 | S | S | * | . | G | 310 helix | trans | -77.7 | -15.9 | -179.9 | 54.3 | 0 | 0 | 0 | 0 | 114.9 | R110 | R110-S112 PolarHBondContact O-N 3.1Š|
| 113 | R | 54.5 | Low | 75.8 | Confident | 215 Ų | 215 | 74 Ų | 74 | 81% | 0.811 | 38% | 0.376 | S | S | * | . | G | 310 helix | trans | -112.3 | 35.2 | -179.5 | -66.4 | -174.6 | 177.4 | 159.1 | -0.2 | 112.4 | R110 | R110-R113 PolarHBondContact O-N 3.49Š|
| 114 | G | 50 | Low | 76.1 | Confident | 58 Ų | 58 | 73.3 Ų | 73.3 | 60% | 0.598 | 37% | 0.374 | S | S | * | . | trans | -12.4 | 111.1 | -172.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | R116 | G114-R116 PolarHBondContact O-N 3.29Š| ||
| 115 | P | 51.9 | Low | 76.7 | Confident | 48 Ų | 48 | 75.2 Ų | 75.2 | 31% | 0.312 | 38% | 0.382 | S | S | . | . | trans | -60 | 142.6 | -178.6 | 8.2 | -8.5 | 0 | 0 | 0 | 109.7 | T117 L120 | P115-T117 HydrophobicContact CB-CG2 4.14Å; P115-T117 HydrophobicContact CG-CG2 3.94Å; P115-T117 VanDerWaalsContact O-CG2 3.24Å; P115-T117 WeakPolarHBondContact O-CG2 3.33Å; P115-T117 PolarHBondContact O-N 3.48Å; P115-L120 HydrophobicContact CB-CD2 4.25Å; P115-L120 HydrophobicContact CG-CD2 4.47Å | ||
| 116 | R | 61.5 | Low | 77.1 | Confident | 208 Ų | 208 | 77 Ų | 77 | 79% | 0.785 | 40% | 0.396 | S | S | * | . | trans | -60 | 90.2 | 158 | -85.4 | -175 | -178.3 | 168.3 | 1 | 107 | G114 D118 H119 L120 | G114-R116 PolarHBondContact O-N 3.29Å; R116-D118 VanDerWaalsContact C-N 3.26Å; R116-D118 PolarHBondContact O-N 2.89Å; R116-H119 PolarHBondContact O-N 3.47Å; R116-L120 PolarHBondContact O-N 3.36Å | ||
| 117 | T | 68 | Low | 77.6 | Confident | 29 Ų | 29 | 79 Ų | 79 | 18% | 0.178 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -70.6 | -21.8 | -158.5 | 33.5 | 0 | 0 | 0 | 0 | 114.2 | R45 P115 L121 | R45-T117 PolarHBondContact NH1-OG1 2.96Å; P115-T117 HydrophobicContact CB-CG2 4.14Å; P115-T117 HydrophobicContact CG-CG2 3.94Å; P115-T117 VanDerWaalsContact O-CG2 3.24Å; P115-T117 WeakPolarHBondContact O-CG2 3.33Å; P115-T117 PolarHBondContact O-N 3.48Å; T117-L121 WeakPolarHBondContact O-CG 3.47Å; T117-L121 PolarHBondContact O-N 3.18Å |
| 118 | D | 74.4 | Confident | 78.5 | Confident | 121 Ų | 121 | 76.8 Ų | 76.8 | 65% | 0.647 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -78.2 | -39.9 | -179.1 | -58.9 | -22.5 | 0 | 0 | 0 | 111.6 | R116 L120 L121 W122 | R116-D118 VanDerWaalsContact C-N 3.26Å; R116-D118 PolarHBondContact O-N 2.89Å; D118-L120 VanDerWaalsContact C-N 3.3Å; D118-L120 PolarHBondContact O-N 3.27Å; D118-L121 PolarHBondContact O-N 2.79Å; D118-W122 PolarHBondContact O-N 3.44Å |
| 119 | H | 84.3 | Confident | 79.4 | Confident | 129 Ų | 129 | 78.4 Ų | 78.4 | 60% | 0.597 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -63.8 | -35.8 | 173.6 | -70.5 | -79.4 | 0 | 0 | 0 | 112.2 | R116 W122 A123 | R116-H119 PolarHBondContact O-N 3.47Å; H119-W122 PolarHBondContact O-N 2.89Å; H119-A123 WeakPolarHBondContact O-CB 3.46Å; H119-A123 PolarHBondContact O-N 2.58Å |
| 120 | L | 87.8 | Confident | 80.2 | Confident | 30 Ų | 30 | 78 Ų | 78 | 16% | 0.157 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -67.5 | -43.7 | 178.3 | -178.2 | 64 | 0 | 0 | 0 | 112 | Y103 L106 P115 R116 D118 W122 A123 F124 | Y103-L120 HydrophobicContact CD2-CD2 4.46Å; L106-L120 HydrophobicContact CD1-CD1 4.23Å; L106-L120 HydrophobicContact CD1-CD2 3.66Å; P115-L120 HydrophobicContact CB-CD2 4.25Å; P115-L120 HydrophobicContact CG-CD2 4.47Å; R116-L120 PolarHBondContact O-N 3.36Å; D118-L120 VanDerWaalsContact C-N 3.3Å; D118-L120 PolarHBondContact O-N 3.27Å; L120-W122 VanDerWaalsContact C-N 3.33Å; L120-A123 PolarHBondContact O-N 2.82Å; L120-F124 HydrophobicContact CD1-CE1 3.85Å; L120-F124 HydrophobicContact CD1-CE2 4.15Å; L120-F124 HydrophobicContact CD1-CZ 3.63Å; L120-F124 HydrophobicContact CD2-CE2 4.11Å; L120-F124 HydrophobicContact CD2-CZ 4.08Å; L120-F124 HydrophobicContact CG-CD2 4.37Å; L120-F124 HydrophobicContact CG-CE1 4.35Å; L120-F124 HydrophobicContact CG-CE2 3.73Å; L120-F124 HydrophobicContact CG-CZ 3.72Å; L120-F124 WeakPolarHBondContact O-CG 3.49Å; L120-F124 PolarHBondContact O-N 3.04Å |
| 121 | L | 88.4 | Confident | 81.1 | Confident | 20 Ų | 20 | 75.2 Ų | 75.2 | 11% | 0.105 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.5 | -41.6 | 176.1 | -71.6 | 177.4 | 0 | 0 | 0 | 111.3 | L49 T117 D118 F124 H125 | L49-L121 HydrophobicContact CD2-CD2 3.74Å; L49-L121 HydrophobicContact CG-CD2 4.35Å; T117-L121 WeakPolarHBondContact O-CG 3.47Å; T117-L121 PolarHBondContact O-N 3.18Å; D118-L121 PolarHBondContact O-N 2.79Å; L121-F124 HydrophobicContact CD2-CD2 4.3Å; L121-F124 PolarHBondContact O-N 2.95Å; L121-H125 PolarHBondContact O-CD2 3.09Å; L121-H125 VanDerWaalsContact O-CD2 3.23Å; L121-H125 PolarHBondContact O-N 3.02Å |
| 122 | W | 91.1 | Very high | 82.6 | Confident | 178 Ų | 178 | 72.8 Ų | 72.8 | 67% | 0.674 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -61.2 | -44.2 | 174.9 | -173.1 | 89.2 | 0 | 0 | 0 | 111.9 | D118 H119 L120 F124 H125 V126 | D118-W122 PolarHBondContact O-N 3.44Å; H119-W122 PolarHBondContact O-N 2.89Å; L120-W122 VanDerWaalsContact C-N 3.33Å; W122-F124 VanDerWaalsContact C-N 3.3Å; W122-F124 PolarHBondContact O-N 3Å; W122-H125 WeakPolarHBondContact O-CB 3.5Å; W122-H125 PolarHBondContact O-N 3.49Å; W122-H125 VanDerWaalsContact O-N 3.1Å; W122-V126 HydrophobicContact CD2-CG2 3.82Å; W122-V126 HydrophobicContact CE3-CG2 3.79Å; W122-V126 HydrophobicContact CH2-CG2 3.58Å; W122-V126 HydrophobicContact CZ2-CG2 3.57Å; W122-V126 HydrophobicContact CZ3-CB 4.46Å; W122-V126 HydrophobicContact CZ3-CG2 3.68Å; W122-V126 WeakPolarHBondContact O-CG2 3.33Å; W122-V126 PolarHBondContact O-N 3.27Å |
| 123 | A | 94.1 | Very high | 84.7 | Confident | 38 Ų | 38 | 71.6 Ų | 71.6 | 31% | 0.314 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -58.7 | -41.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | H119 L120 H125 V126 V127 | H119-A123 WeakPolarHBondContact O-CB 3.46Å; H119-A123 PolarHBondContact O-N 2.58Å; L120-A123 PolarHBondContact O-N 2.82Å; A123-H125 VanDerWaalsContact C-N 3.33Å; A123-H125 PolarHBondContact O-N 3.37Å; A123-V126 PolarHBondContact O-N 3.22Å; A123-V127 WeakPolarHBondContact O-CB 3.38Å; A123-V127 VanDerWaalsContact O-CG2 3.29Å; A123-V127 WeakPolarHBondContact O-CG2 3.49Å; A123-V127 PolarHBondContact O-N 2.95Å |
| 124 | F | 95.3 | Very high | 86.7 | Confident | 16 Ų | 16 | 66.2 Ų | 66.2 | 7% | 0.07 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.6 | -39.4 | 174.5 | -65.9 | -29.5 | 0 | 0 | 0 | 113 | L49 W96 A99 F102 Y103 L120 L121 W122 S128 | L49-F124 HydrophobicContact CD1-CD2 4.4Å; L49-F124 HydrophobicContact CD1-CE2 4.3Å; L49-F124 HydrophobicContact CD2-CD2 3.78Å; L49-F124 HydrophobicContact CD2-CE2 4.47Å; W96-F124 HydrophobicContact CH2-CB 4.19Å; W96-F124 HydrophobicContact CZ3-CB 3.91Å; A99-F124 HydrophobicContact CB-CB 4.31Å; A99-F124 HydrophobicContact CB-CD1 3.78Å; A99-F124 HydrophobicContact CB-CD2 4.4Å; A99-F124 HydrophobicContact CB-CE1 4.13Å; A99-F124 HydrophobicContact CB-CG 3.93Å; F102-F124 AromaticContact CD1-CE1 3.84Å; F102-F124 HydrophobicContact CD1-CE1 3.84Å; F102-F124 AromaticContact CD1-CZ 3.91Å; F102-F124 HydrophobicContact CD1-CZ 3.91Å; Y103-F124 HydrophobicContact CD2-CE2 4.16Å; Y103-F124 HydrophobicContact CG-CE2 4.48Å; L120-F124 HydrophobicContact CD1-CE1 3.85Å; L120-F124 HydrophobicContact CD1-CE2 4.15Å; L120-F124 HydrophobicContact CD1-CZ 3.63Å; L120-F124 HydrophobicContact CD2-CE2 4.11Å; L120-F124 HydrophobicContact CD2-CZ 4.08Å; L120-F124 HydrophobicContact CG-CD2 4.37Å; L120-F124 HydrophobicContact CG-CE1 4.35Å; L120-F124 HydrophobicContact CG-CE2 3.73Å; L120-F124 HydrophobicContact CG-CZ 3.72Å; L120-F124 WeakPolarHBondContact O-CG 3.49Å; L120-F124 PolarHBondContact O-N 3.04Å; L121-F124 HydrophobicContact CD2-CD2 4.3Å; L121-F124 PolarHBondContact O-N 2.95Å; W122-F124 VanDerWaalsContact C-N 3.3Å; W122-F124 PolarHBondContact O-N 3Å; F124-S128 WeakPolarHBondContact O-CB 3.25Å; F124-S128 PolarHBondContact O-N 3.25Å; F124-S128 PolarHBondContact O-OG 3.05Å |
| 125 | H | 95.7 | Very high | 89 | Confident | 49 Ų | 49 | 64.5 Ų | 64.5 | 23% | 0.227 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -63 | -49.9 | 174.3 | -82.9 | -72.4 | 0 | 0 | 0 | 112.7 | F52 W96 L121 W122 A123 V127 S128 W129 | F52-H125 AromaticContact CD1-CE1 3.87Å; F52-H125 AromaticContact CD2-CE1 3.49Å; F52-H125 VanDerWaalsContact CD2-CE1 3.49Å; F52-H125 WeakPolarHBondContact CD2-CE1 3.14Å; F52-H125 AromaticContact CD2-NE2 3.81Å; F52-H125 AromaticContact CE1-CE1 3.59Å; F52-H125 AromaticContact CE2-CE1 3.16Å; F52-H125 WeakPolarHBondContact CE2-CE1 3.47Å; F52-H125 AromaticContact CE2-NE2 3.19Å; F52-H125 WeakPolarHBondContact CE2-NE2 3.36Å; F52-H125 AromaticContact CG-CE1 3.86Å; F52-H125 AromaticContact CZ-CE1 3.23Å; F52-H125 WeakPolarHBondContact CZ-CE1 3.26Å; F52-H125 AromaticContact CZ-NE2 3.51Å; W96-H125 AromaticContact CH2-CE1 3.78Å; W96-H125 AromaticContact CH2-CG 4Å; W96-H125 AromaticContact CH2-ND1 3.71Å; W96-H125 AromaticContact CZ2-CE1 3.97Å; W96-H125 AromaticContact CZ2-ND1 3.68Å; L121-H125 PolarHBondContact O-CD2 3.09Å; L121-H125 VanDerWaalsContact O-CD2 3.23Å; L121-H125 PolarHBondContact O-N 3.02Å; W122-H125 WeakPolarHBondContact O-CB 3.5Å; W122-H125 PolarHBondContact O-N 3.49Å; W122-H125 VanDerWaalsContact O-N 3.1Å; A123-H125 VanDerWaalsContact C-N 3.33Å; A123-H125 PolarHBondContact O-N 3.37Å; H125-V127 VanDerWaalsContact C-N 3.31Å; H125-V127 PolarHBondContact O-N 3.31Å; H125-S128 PolarHBondContact O-N 2.96Å; H125-W129 AromaticContact ND1-CD1 3.57Å; H125-W129 AromaticContact ND1-NE1 3.56Å; H125-W129 WeakPolarHBondContact O-CB 3.19Å; H125-W129 PolarHBondContact O-N 3.24Å |
| 126 | V | 96.4 | Very high | 91.1 | Very high | 66 Ų | 66 | 62.7 Ų | 62.7 | 40% | 0.4 | 31% | 0.314 | S | S | . | . | I | π-helix | trans | -60.8 | -43.9 | -179.3 | 172.2 | 0 | 0 | 0 | 0 | 110.9 | W122 A123 G130 | W122-V126 HydrophobicContact CD2-CG2 3.82Å; W122-V126 HydrophobicContact CE3-CG2 3.79Å; W122-V126 HydrophobicContact CH2-CG2 3.58Å; W122-V126 HydrophobicContact CZ2-CG2 3.57Å; W122-V126 HydrophobicContact CZ3-CB 4.46Å; W122-V126 HydrophobicContact CZ3-CG2 3.68Å; W122-V126 WeakPolarHBondContact O-CG2 3.33Å; W122-V126 PolarHBondContact O-N 3.27Å; A123-V126 PolarHBondContact O-N 3.22Å; V126-G130 WeakPolarHBondContact O-CA 3.38Å; V126-G130 PolarHBondContact O-N 2.87Å |
| 127 | V | 97.1 | Very high | 92.9 | Very high | 59 Ų | 59 | 56.9 Ų | 56.9 | 36% | 0.358 | 30% | 0.302 | S | S | . | . | I | π-helix | trans | -71.7 | -46 | -179.4 | 169 | 0 | 0 | 0 | 0 | 111.3 | F95 A123 H125 I131 P132 | F95-V127 HydrophobicContact CD1-CG1 3.56Å; F95-V127 HydrophobicContact CE1-CG1 3.87Å; A123-V127 WeakPolarHBondContact O-CB 3.38Å; A123-V127 VanDerWaalsContact O-CG2 3.29Å; A123-V127 WeakPolarHBondContact O-CG2 3.49Å; A123-V127 PolarHBondContact O-N 2.95Å; H125-V127 VanDerWaalsContact C-N 3.31Å; H125-V127 PolarHBondContact O-N 3.31Å; V127-I131 HydrophobicContact CB-CD1 4.46Å; V127-I131 HydrophobicContact CG1-CD1 4.01Å; V127-I131 HydrophobicContact CG2-CD1 4.49Å; V127-I131 WeakPolarHBondContact O-CB 3.47Å; V127-I131 PolarHBondContact O-N 3.28Å; V127-P132 WeakPolarHBondContact O-CD 3.4Å |
| 128 | S | 97.9 | Very high | 94.2 | Very high | 1 Ų | 1 | 57.2 Ų | 57.2 | 1% | 0.007 | 31% | 0.307 | C | S | . | . | I | π-helix | trans | -83.7 | -19.3 | -169.8 | -44 | 0 | 0 | 0 | 0 | 114.2 | S92 W96 F124 H125 P132 | S92-S128 WeakPolarHBondContact CA-O 3.37Å; S92-S128 VanDerWaalsContact CB-O 3.26Å; S92-S128 WeakPolarHBondContact CB-O 3.33Å; S92-S128 PolarHBondContact OG-O 2.68Å; W96-S128 VanDerWaalsContact CE2-CB 3.43Å; F124-S128 WeakPolarHBondContact O-CB 3.25Å; F124-S128 PolarHBondContact O-N 3.25Å; F124-S128 PolarHBondContact O-OG 3.05Å; H125-S128 PolarHBondContact O-N 2.96Å; S128-P132 WeakPolarHBondContact O-CG 3.26Å |
| 129 | W | 98.3 | Very high | 95.2 | Very high | 60 Ų | 60 | 51.4 Ų | 51.4 | 23% | 0.227 | 28% | 0.276 | C | S | . | . | I | π-helix | trans | -106.9 | -43.5 | 171 | -62.8 | 121.9 | 0 | 0 | 0 | 112.1 | F52 A56 F88 S92 W96 H125 L133 | F52-W129 HydrophobicContact CB-CZ2 4.1Å; F52-W129 HydrophobicContact CD1-CZ2 4.5Å; A56-W129 HydrophobicContact CB-CH2 3.8Å; A56-W129 HydrophobicContact CB-CZ3 4.07Å; F88-W129 HydrophobicContact CE1-CE3 4.23Å; F88-W129 HydrophobicContact CE1-CZ3 4.21Å; F88-W129 HydrophobicContact CE2-CE3 4.12Å; F88-W129 AromaticContact CZ-CE3 3.52Å; F88-W129 HydrophobicContact CZ-CE3 3.52Å; F88-W129 AromaticContact CZ-CZ3 3.96Å; F88-W129 HydrophobicContact CZ-CZ3 3.96Å; S92-W129 VanDerWaalsContact OG-CE3 3.28Å; W96-W129 AromaticContact CE2-CE2 3.82Å; W96-W129 AromaticContact CE2-NE1 3.7Å; W96-W129 AromaticContact CZ2-CD1 3.69Å; W96-W129 AromaticContact CZ2-CE2 3.88Å; W96-W129 HydrophobicContact CZ2-CZ2 4.43Å; W96-W129 AromaticContact CZ2-NE1 3.26Å; W96-W129 VanDerWaalsContact CZ2-NE1 3.26Å; W96-W129 AromaticContact NE1-CD2 3.69Å; W96-W129 AromaticContact NE1-CE2 3.2Å; W96-W129 AromaticContact NE1-CH2 3.83Å; W96-W129 AromaticContact NE1-CZ2 3.28Å; W96-W129 VanDerWaalsContact NE1-CZ2 3.28Å; W96-W129 AromaticContact NE1-NE1 3.56Å; H125-W129 AromaticContact ND1-CD1 3.57Å; H125-W129 AromaticContact ND1-NE1 3.56Å; H125-W129 WeakPolarHBondContact O-CB 3.19Å; H125-W129 PolarHBondContact O-N 3.24Å; W129-L133 WeakPolarHBondContact O-CB 3.27Å; W129-L133 PolarHBondContact O-N 3.08Å |
| 130 | G | 98 | Very high | 95.7 | Very high | 26 Ų | 26 | 48 Ų | 48 | 27% | 0.268 | 27% | 0.265 | S | S | . | . | I | π-helix | trans | -68.4 | -48.6 | -173.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | V126 L133 V134 | V126-G130 WeakPolarHBondContact O-CA 3.38Å; V126-G130 PolarHBondContact O-N 2.87Å; G130-L133 PolarHBondContact O-N 3.22Å; G130-V134 WeakPolarHBondContact O-CG2 3.34Å; G130-V134 PolarHBondContact O-N 3.42Å |
| 131 | I | 97 | Very high | 96 | Very high | 62 Ų | 62 | 50.3 Ų | 50.3 | 32% | 0.318 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -61.4 | -50.6 | 179.7 | -61.9 | 178 | 0 | 0 | 0 | 111.1 | F95 V127 L133 V134 I135 W177 | F95-I131 HydrophobicContact CE1-CB 4.44Å; F95-I131 HydrophobicContact CE1-CD1 4.08Å; F95-I131 HydrophobicContact CE1-CG2 4.35Å; F95-I131 HydrophobicContact CE2-CG2 4.36Å; F95-I131 HydrophobicContact CZ-CB 4.21Å; F95-I131 HydrophobicContact CZ-CD1 4.46Å; F95-I131 HydrophobicContact CZ-CG2 3.74Å; V127-I131 HydrophobicContact CB-CD1 4.46Å; V127-I131 HydrophobicContact CG1-CD1 4.01Å; V127-I131 HydrophobicContact CG2-CD1 4.49Å; V127-I131 WeakPolarHBondContact O-CB 3.47Å; V127-I131 PolarHBondContact O-N 3.28Å; I131-L133 VanDerWaalsContact C-N 3.31Å; I131-L133 PolarHBondContact O-N 3.48Å; I131-V134 PolarHBondContact O-N 2.92Å; I131-I135 HydrophobicContact CG2-CD1 3.66Å; I131-I135 HydrophobicContact CG2-CG1 4.4Å; I131-I135 VanDerWaalsContact O-CG1 3.3Å; I131-I135 WeakPolarHBondContact O-CG1 3.48Å; I131-I135 PolarHBondContact O-N 3.25Å; I131-W177 HydrophobicContact CG2-CH2 4.37Å; I131-W177 HydrophobicContact CG2-CZ2 4.21Å |
| 132 | P | 98.1 | Very high | 96.3 | Very high | 0 Ų | 0 | 54.1 Ų | 54.1 | 0% | 0 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -56.6 | -42.2 | 174.1 | -30.2 | 39.8 | 0 | 0 | 0 | 113.2 | F88 T91 S92 F95 V127 S128 I135 T136 | F88-P132 HydrophobicContact CD2-CB 3.92Å; F88-P132 HydrophobicContact CE2-CB 4.28Å; T91-P132 HydrophobicContact CG2-CB 4.06Å; T91-P132 HydrophobicContact CG2-CG 3.91Å; S92-P132 WeakPolarHBondContact OG-CB 3.5Å; S92-P132 WeakPolarHBondContact OG-CG 3.42Å; F95-P132 HydrophobicContact CD2-CG 3.82Å; F95-P132 HydrophobicContact CE2-CG 4.12Å; V127-P132 WeakPolarHBondContact O-CD 3.4Å; S128-P132 WeakPolarHBondContact O-CG 3.26Å; P132-I135 PolarHBondContact O-N 3.1Å; P132-T136 WeakPolarHBondContact O-CB 3.49Å; P132-T136 PolarHBondContact O-N 2.82Å; P132-T136 PolarHBondContact O-OG1 3.04Å |
| 133 | L | 98.2 | Very high | 96.3 | Very high | 90 Ų | 90 | 54.1 Ų | 54.1 | 47% | 0.471 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62 | -47.8 | 179.3 | -178 | 63.9 | 0 | 0 | 0 | 111.7 | F88 W129 G130 I131 I135 T136 V137 | F88-L133 HydrophobicContact CD2-CB 4.13Å; F88-L133 HydrophobicContact CD2-CD1 4.39Å; F88-L133 HydrophobicContact CE2-CB 3.85Å; F88-L133 HydrophobicContact CE2-CD1 4.33Å; W129-L133 WeakPolarHBondContact O-CB 3.27Å; W129-L133 PolarHBondContact O-N 3.08Å; G130-L133 PolarHBondContact O-N 3.22Å; I131-L133 VanDerWaalsContact C-N 3.31Å; I131-L133 PolarHBondContact O-N 3.48Å; L133-I135 VanDerWaalsContact C-N 3.34Å; L133-I135 PolarHBondContact O-N 3.09Å; L133-T136 PolarHBondContact O-N 2.97Å; L133-V137 HydrophobicContact CD1-CG2 4.05Å; L133-V137 HydrophobicContact CG-CG2 4.34Å; L133-V137 WeakPolarHBondContact O-CB 3.3Å; L133-V137 VanDerWaalsContact O-CG2 3.25Å; L133-V137 WeakPolarHBondContact O-CG2 3.42Å; L133-V137 PolarHBondContact O-N 3.39Å |
| 134 | V | 98.1 | Very high | 96.2 | Very high | 102 Ų | 102 | 54.1 Ų | 54.1 | 62% | 0.618 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -60.8 | -44.7 | 179 | 170 | 0 | 0 | 0 | 0 | 110.9 | G130 I131 V137 A138 | G130-V134 WeakPolarHBondContact O-CG2 3.34Å; G130-V134 PolarHBondContact O-N 3.42Å; I131-V134 PolarHBondContact O-N 2.92Å; V134-V137 PolarHBondContact O-N 3.29Å; V134-A138 VanDerWaalsContact O-CB 3.29Å; V134-A138 WeakPolarHBondContact O-CB 3.47Å; V134-A138 PolarHBondContact O-N 2.91Å |
| 135 | I | 96.9 | Very high | 95.8 | Very high | 23 Ų | 23 | 53.7 Ų | 53.7 | 12% | 0.118 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.7 | -48.7 | 178.1 | -68.8 | 168.9 | 0 | 0 | 0 | 110.6 | I131 P132 L133 A138 A139 L172 T173 W177 | I131-I135 HydrophobicContact CG2-CD1 3.66Å; I131-I135 HydrophobicContact CG2-CG1 4.4Å; I131-I135 VanDerWaalsContact O-CG1 3.3Å; I131-I135 WeakPolarHBondContact O-CG1 3.48Å; I131-I135 PolarHBondContact O-N 3.25Å; P132-I135 PolarHBondContact O-N 3.1Å; L133-I135 VanDerWaalsContact C-N 3.34Å; L133-I135 PolarHBondContact O-N 3.09Å; I135-A138 PolarHBondContact O-N 3.41Å; I135-A139 WeakPolarHBondContact O-CB 3.38Å; I135-A139 PolarHBondContact O-N 2.83Å; I135-L172 WeakPolarHBondContact CG2-O 3.44Å; I135-T173 HydrophobicContact CG2-CG2 3.89Å; I135-W177 HydrophobicContact CD1-CZ2 3.7Å |
| 136 | T | 97.3 | Very high | 95.3 | Very high | 9 Ų | 9 | 51.7 Ų | 51.7 | 6% | 0.055 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -63.3 | -46 | 179.7 | -60.6 | 0 | 0 | 0 | 0 | 111.5 | A84 F88 P132 L133 A138 A139 V140 I145 | A84-T136 HydrophobicContact CB-CG2 3.86Å; A84-T136 VanDerWaalsContact O-CG2 3.3Å; A84-T136 WeakPolarHBondContact O-CG2 3.27Å; F88-T136 WeakPolarHBondContact CA-OG1 3.42Å; F88-T136 HydrophobicContact CB-CG2 4.16Å; F88-T136 PolarHBondContact N-OG1 3.28Å; P132-T136 WeakPolarHBondContact O-CB 3.49Å; P132-T136 PolarHBondContact O-N 2.82Å; P132-T136 PolarHBondContact O-OG1 3.04Å; L133-T136 PolarHBondContact O-N 2.97Å; T136-A138 VanDerWaalsContact C-N 3.33Å; T136-A138 PolarHBondContact O-N 3.04Å; T136-A139 PolarHBondContact O-N 3.45Å; T136-V140 HydrophobicContact CG2-CG2 4.44Å; T136-V140 WeakPolarHBondContact O-CG2 3.42Å; T136-V140 PolarHBondContact O-N 3.32Å; T136-I145 HydrophobicContact CG2-CD1 4.19Å |
| 137 | V | 97.6 | Very high | 94.5 | Very high | 87 Ų | 87 | 51.7 Ų | 51.7 | 53% | 0.527 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -61.3 | -43.1 | 178.3 | 169 | 0 | 0 | 0 | 0 | 110.8 | L133 V134 V140 A141 | L133-V137 HydrophobicContact CD1-CG2 4.05Å; L133-V137 HydrophobicContact CG-CG2 4.34Å; L133-V137 WeakPolarHBondContact O-CB 3.3Å; L133-V137 VanDerWaalsContact O-CG2 3.25Å; L133-V137 WeakPolarHBondContact O-CG2 3.42Å; L133-V137 PolarHBondContact O-N 3.39Å; V134-V137 PolarHBondContact O-N 3.29Å; V137-V140 PolarHBondContact O-N 2.89Å; V137-A141 VanDerWaalsContact O-CB 3.26Å; V137-A141 WeakPolarHBondContact O-CB 3.37Å; V137-A141 PolarHBondContact O-N 2.82Å |
| 138 | A | 96.6 | Very high | 93.3 | Very high | 35 Ų | 35 | 49 Ų | 49 | 29% | 0.289 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -62 | -43.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V134 I135 T136 V140 A141 L142 W169 | V134-A138 VanDerWaalsContact O-CB 3.29Å; V134-A138 WeakPolarHBondContact O-CB 3.47Å; V134-A138 PolarHBondContact O-N 2.91Å; I135-A138 PolarHBondContact O-N 3.41Å; T136-A138 VanDerWaalsContact C-N 3.33Å; T136-A138 PolarHBondContact O-N 3.04Å; A138-V140 PolarHBondContact O-N 3.45Å; A138-A141 PolarHBondContact O-N 3.37Å; A138-L142 VanDerWaalsContact O-CB 3.31Å; A138-L142 WeakPolarHBondContact O-CB 3.3Å; A138-L142 VanDerWaalsContact O-CG 3.28Å; A138-L142 WeakPolarHBondContact O-CG 3.36Å; A138-L142 PolarHBondContact O-N 3.36Å; A138-W169 HydrophobicContact CB-CH2 4.25Å; A138-W169 HydrophobicContact CB-CZ3 4.48Å |
| 139 | A | 94.8 | Very high | 91.8 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -63.1 | -40.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | I135 T136 K143 K144 I145 W169 T173 | I135-A139 WeakPolarHBondContact O-CB 3.38Å; I135-A139 PolarHBondContact O-N 2.83Å; T136-A139 PolarHBondContact O-N 3.45Å; A139-K143 PolarHBondContact O-N 3.1Å; A139-K144 HydrophobicContact CB-CB 4.38Å; A139-K144 WeakPolarHBondContact O-CB 3.36Å; A139-K144 PolarHBondContact O-N 2.94Å; A139-I145 HydrophobicContact CB-CD1 4Å; A139-I145 HydrophobicContact CB-CG1 3.79Å; A139-W169 HydrophobicContact CB-CE3 3.74Å; A139-W169 HydrophobicContact CB-CZ3 3.68Å; A139-T173 HydrophobicContact CB-CG2 3.96Å |
| 140 | V | 94.8 | Very high | 90.2 | Very high | 58 Ų | 58 | 47.8 Ų | 47.8 | 35% | 0.352 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -67.3 | -47.9 | 174.7 | 173.6 | 0 | 0 | 0 | 0 | 111.1 | V80 A84 T136 V137 A138 L142 K143 I145 | V80-V140 HydrophobicContact CG1-CG1 4.47Å; A84-V140 HydrophobicContact CB-CG2 3.72Å; T136-V140 HydrophobicContact CG2-CG2 4.44Å; T136-V140 WeakPolarHBondContact O-CG2 3.42Å; T136-V140 PolarHBondContact O-N 3.32Å; V137-V140 PolarHBondContact O-N 2.89Å; A138-V140 PolarHBondContact O-N 3.45Å; V140-L142 PolarHBondContact O-N 3.31Å; V140-K143 PolarHBondContact O-N 3.06Å; V140-I145 HydrophobicContact CG2-CD1 3.85Å; V140-I145 HydrophobicContact CG2-CG1 4.44Å |
| 141 | A | 95.1 | Very high | 88.4 | Confident | 77 Ų | 77 | 48.1 Ų | 48.1 | 64% | 0.636 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -61.3 | -35 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | V137 A138 K143 | V137-A141 VanDerWaalsContact O-CB 3.26Å; V137-A141 WeakPolarHBondContact O-CB 3.37Å; V137-A141 PolarHBondContact O-N 2.82Å; A138-A141 PolarHBondContact O-N 3.37Å; A141-K143 VanDerWaalsContact C-N 3.28Å |
| 142 | L | 93.6 | Very high | 86.7 | Confident | 101 Ų | 101 | 45.8 Ų | 45.8 | 53% | 0.529 | 26% | 0.259 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.1 | 7.8 | 177.2 | -63.1 | 173 | 0 | 0 | 0 | 113.4 | A138 V140 K144 W169 | A138-L142 VanDerWaalsContact O-CB 3.31Å; A138-L142 WeakPolarHBondContact O-CB 3.3Å; A138-L142 VanDerWaalsContact O-CG 3.28Å; A138-L142 WeakPolarHBondContact O-CG 3.36Å; A138-L142 PolarHBondContact O-N 3.36Å; V140-L142 PolarHBondContact O-N 3.31Å; L142-K144 VanDerWaalsContact C-N 3.32Å; L142-K144 HydrophobicContact CB-CG 3.79Å; L142-K144 WeakPolarHBondContact O-CE 3.21Å; L142-K144 PolarHBondContact O-N 2.95Å; L142-W169 HydrophobicContact CB-CZ2 4.5Å; L142-W169 HydrophobicContact CD1-CH2 3.62Å; L142-W169 HydrophobicContact CD1-CZ2 3.41Å; L142-W169 VanDerWaalsContact CD1-CZ2 3.41Å |
| 143 | K | 91.3 | Very high | 85.4 | Confident | 177 Ų | 177 | 45.8 Ų | 45.8 | 77% | 0.77 | 26% | 0.259 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.7 | 45.5 | 179.5 | -56.9 | -178.3 | 179.8 | -177.6 | 0 | 113 | A139 V140 A141 | A139-K143 PolarHBondContact O-N 3.1Å; V140-K143 PolarHBondContact O-N 3.06Å; A141-K143 VanDerWaalsContact C-N 3.28Å |
| 144 | K | 91.9 | Very high | 84.3 | Confident | 38 Ų | 38 | 41.5 Ų | 41.5 | 17% | 0.165 | 24% | 0.236 | C | C | . | . | trans | -100.1 | -20.6 | -178.8 | -54.4 | -63.9 | -179 | 176.6 | 0 | 112.9 | A139 L142 I159 D160 A163 D165 W169 | A139-K144 HydrophobicContact CB-CB 4.38Å; A139-K144 WeakPolarHBondContact O-CB 3.36Å; A139-K144 PolarHBondContact O-N 2.94Å; L142-K144 VanDerWaalsContact C-N 3.32Å; L142-K144 HydrophobicContact CB-CG 3.79Å; L142-K144 WeakPolarHBondContact O-CE 3.21Å; L142-K144 PolarHBondContact O-N 2.95Å; K144-I159 WeakPolarHBondContact O-CA 3.45Å; K144-D160 PolarHBondContact O-N 3.12Å; K144-A163 HydrophobicContact CD-CB 4.47Å; K144-D165 WeakPolarHBondContact CE-OD2 3.33Å; K144-D165 VanDerWaalsContact NZ-CG 3.25Å; K144-D165 IonicContact NZ-OD1 2.7Å; K144-D165 PolarHBondContact NZ-OD1 3.4Å; K144-D165 IonicContact NZ-OD2 2.98Å; K144-D165 PolarHBondContact NZ-OD2 2.86Å; K144-W169 HydrophobicContact CB-CB 4.4Å; K144-W169 HydrophobicContact CB-CD2 3.91Å; K144-W169 HydrophobicContact CB-CE3 4.34Å; K144-W169 HydrophobicContact CB-CG 3.88Å; K144-W169 HydrophobicContact CD-CD2 4.44Å; K144-W169 HydrophobicContact CD-CG 4.22Å; K144-W169 HydrophobicContact CG-CD2 3.73Å; K144-W169 HydrophobicContact CG-CE3 4.39Å; K144-W169 HydrophobicContact CG-CG 3.9Å; K144-W169 HydrophobicContact CG-CZ2 4.1Å | ||
| 145 | I | 88.1 | Confident | 83.4 | Confident | 8 Ų | 8 | 37 Ų | 37 | 4% | 0.041 | 21% | 0.211 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87.3 | 131.2 | 172.1 | -61.6 | -169.6 | 0 | 0 | 0 | 108.4 | V80 A84 T136 A139 V140 W158 I159 | V80-I145 HydrophobicContact CG1-CG2 4.45Å; A84-I145 HydrophobicContact CB-CD1 4.08Å; T136-I145 HydrophobicContact CG2-CD1 4.19Å; A139-I145 HydrophobicContact CB-CD1 4Å; A139-I145 HydrophobicContact CB-CG1 3.79Å; V140-I145 HydrophobicContact CG2-CD1 3.85Å; V140-I145 HydrophobicContact CG2-CG1 4.44Å; I145-W158 CarbonylContact C-O 3.42Å; I145-W158 VanDerWaalsContact CA-O 3.22Å; I145-W158 WeakPolarHBondContact CA-O 3.25Å; I145-W158 WeakPolarHBondContact CG2-O 3.35Å; I145-I159 HydrophobicContact CG1-CD1 4.19Å |
| 146 | G | 84.3 | Confident | 82.9 | Confident | 6 Ų | 6 | 36.4 Ų | 36.4 | 6% | 0.062 | 21% | 0.207 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -176.1 | -167 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | D148 W158 | G146-D148 PolarHBondContact O-N 2.7Å; G146-W158 PolarHBondContact N-O 3.42Å; G146-W158 CarbonylContact O-C 3.57Å; G146-W158 PolarHBondContact O-N 2.98Å |
| 147 | Y | 78.9 | Confident | 82.6 | Confident | 66 Ų | 66 | 36 Ų | 36 | 26% | 0.259 | 21% | 0.205 | S | C | . | . | trans | -68.6 | 126.2 | 177.7 | -178.4 | -106.3 | 0 | 0 | 0 | 110 | F72 A149 | F72-Y147 HydrophobicContact CB-CD2 3.73Å; F72-Y147 HydrophobicContact CB-CE2 3.7Å; F72-Y147 WeakPolarHBondContact O-CE2 3.49Å; F72-Y147 PolarHBondContact O-OH 3.05Å; Y147-A149 HydrophobicContact CD1-CB 4.43Å; Y147-A149 HydrophobicContact CE1-CB 3.73Å | ||
| 148 | D | 73.4 | Confident | 82.2 | Confident | 4 Ų | 4 | 33.2 Ų | 33.2 | 2% | 0.021 | 19% | 0.185 | C | C | . | . | trans | -118.4 | 14.1 | -177.6 | 73.2 | -21 | 0 | 0 | 0 | 112.7 | G146 S150 D151 V152 S153 W156 I159 L161 | G146-D148 PolarHBondContact O-N 2.7Å; D148-S150 PolarHBondContact O-N 2.98Å; D148-S150 PolarHBondContact OD1-N 2.67Å; D148-D151 PolarHBondContact O-N 3.48Å; D148-V152 HydrophobicContact CB-CG2 4.06Å; D148-V152 VanDerWaalsContact OD2-CG2 3.26Å; D148-V152 WeakPolarHBondContact OD2-CG2 3.33Å; D148-S153 VanDerWaalsContact CG-OG 3.24Å; D148-S153 PolarHBondContact OD1-OG 2.85Å; D148-S153 WeakPolarHBondContact OD2-CB 3.37Å; D148-S153 PolarHBondContact OD2-N 2.76Å; D148-S153 PolarHBondContact OD2-OG 2.93Å; D148-W156 VanDerWaalsContact OD1-O 3.06Å; D148-I159 WeakPolarHBondContact CB-O 3.17Å; D148-L161 HydrophobicContact CB-CD1 4.5Å; D148-L161 HydrophobicContact CB-CG 4.37Å | ||
| 149 | A | 65.9 | Low | 81.9 | Confident | 18 Ų | 18 | 31.5 Ų | 31.5 | 15% | 0.149 | 17% | 0.171 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 52.4 | 20.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | P7 T8 Y147 D151 | P7-A149 HydrophobicContact CB-CB 3.97Å; T8-A149 PolarHBondContact N-O 2.83Å; Y147-A149 HydrophobicContact CD1-CB 4.43Å; Y147-A149 HydrophobicContact CE1-CB 3.73Å; A149-D151 PolarHBondContact O-N 2.94Å |
| 150 | S | 64.5 | Low | 81.3 | Confident | 16 Ų | 16 | 33.8 Ų | 33.8 | 11% | 0.112 | 18% | 0.183 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 59.7 | 16.2 | -171.8 | -57.6 | 0 | 0 | 0 | 0 | 116 | D148 V152 S153 G155 | D148-S150 PolarHBondContact O-N 2.98Å; D148-S150 PolarHBondContact OD1-N 2.67Å; S150-V152 VanDerWaalsContact C-N 3.31Å; S150-V152 PolarHBondContact O-N 2.78Å; S150-S153 VanDerWaalsContact CA-OG 3.31Å; S150-S153 WeakPolarHBondContact CA-OG 3.41Å; S150-G155 WeakPolarHBondContact OG-CA 3.13Å; S150-G155 PolarHBondContact OG-N 3.48Å |
| 151 | D | 61 | Low | 80.5 | Confident | 34 Ų | 34 | 33.3 Ų | 33.3 | 18% | 0.182 | 18% | 0.178 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -29.2 | 179.9 | -80.4 | -22.7 | 0 | 0 | 0 | 111.9 | T8 D148 A149 L161 R256 | T8-D151 PolarHBondContact OG1-OD1 3.16Å; T8-D151 VanDerWaalsContact OG1-OD1 3.04Å; D148-D151 PolarHBondContact O-N 3.48Å; A149-D151 PolarHBondContact O-N 2.94Å; D151-L161 HydrophobicContact CB-CD1 3.81Å; D151-R256 IonicContact OD1-NH2 3.45Å; D151-R256 PolarHBondContact OD1-NH2 3.45Å |
| 152 | V | 59.7 | Low | 79.6 | Confident | 12 Ų | 12 | 38.2 Ų | 38.2 | 7% | 0.073 | 19% | 0.188 | C | C | . | . | S | Bend | trans | -122.2 | -5.5 | 178.2 | -65.7 | 0 | 0 | 0 | 0 | 113.3 | D148 S150 W158 L161 M170 T248 H264 | D148-V152 HydrophobicContact CB-CG2 4.06Å; D148-V152 VanDerWaalsContact OD2-CG2 3.26Å; D148-V152 WeakPolarHBondContact OD2-CG2 3.33Å; S150-V152 VanDerWaalsContact C-N 3.31Å; S150-V152 PolarHBondContact O-N 2.78Å; V152-W158 HydrophobicContact CB-CE3 4.44Å; V152-W158 HydrophobicContact CB-CZ3 4.44Å; V152-W158 HydrophobicContact CG2-CE3 3.83Å; V152-W158 HydrophobicContact CG2-CZ3 4.21Å; V152-L161 HydrophobicContact CG1-CD2 4.24Å; V152-L161 HydrophobicContact CG2-CD1 4.41Å; V152-L161 HydrophobicContact CG2-CD2 4.05Å; V152-M170 HydrophobicContact CB-CE 3.82Å; V152-M170 HydrophobicContact CG1-CE 3.52Å; V152-M170 HydrophobicContact CG2-CE 4.05Å; V152-T248 HydrophobicContact CG1-CG2 3.59Å; V152-H264 PolarHBondContact O-CE1 2.85Å |
| 153 | S | 71.8 | Confident | 78.9 | Confident | 1 Ų | 1 | 34.1 Ų | 34.1 | 1% | 0.007 | 17% | 0.169 | C | C | . | . | S | Bend | trans | -115.9 | -165.6 | 175.1 | 66.3 | 0 | 0 | 0 | 0 | 111.5 | D148 S150 W156 | D148-S153 VanDerWaalsContact CG-OG 3.24Å; D148-S153 PolarHBondContact OD1-OG 2.85Å; D148-S153 WeakPolarHBondContact OD2-CB 3.37Å; D148-S153 PolarHBondContact OD2-N 2.76Å; D148-S153 PolarHBondContact OD2-OG 2.93Å; S150-S153 VanDerWaalsContact CA-OG 3.31Å; S150-S153 WeakPolarHBondContact CA-OG 3.41Å; S153-W156 WeakPolarHBondContact CB-O 3.13Å; S153-W156 PolarHBondContact OG-O 2.91Å |
| 154 | V | 75 | Confident | 78.5 | Confident | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 18% | 0.177 | C | C | . | . | S | Bend | trans | -136.4 | 69.4 | 177 | -173.1 | 0 | 0 | 0 | 0 | 108.1 | L10 V18 W156 V261 H264 | L10-V154 HydrophobicContact CD1-CG1 4.22Å; L10-V154 HydrophobicContact CD2-CG1 3.7Å; V18-V154 HydrophobicContact CG2-CG1 4Å; V154-W156 HydrophobicContact CB-CE3 4.18Å; V154-W156 HydrophobicContact CB-CH2 3.57Å; V154-W156 HydrophobicContact CB-CZ2 4.13Å; V154-W156 HydrophobicContact CB-CZ3 3.61Å; V154-W156 HydrophobicContact CG1-CZ3 4.41Å; V154-W156 HydrophobicContact CG2-CH2 3.92Å; V154-W156 HydrophobicContact CG2-CZ2 4.28Å; V154-W156 HydrophobicContact CG2-CZ3 4.45Å; V154-W156 VanDerWaalsContact O-CZ3 3.28Å; V154-W156 WeakPolarHBondContact O-CZ3 3.17Å; V154-V261 HydrophobicContact CG1-CG1 3.64Å; V154-V261 HydrophobicContact CG2-CG1 4.44Å; V154-H264 HydrophobicContact CG2-CB 3.95Å; V154-H264 VanDerWaalsContact CG2-ND1 3.31Å; V154-H264 WeakPolarHBondContact CG2-ND1 3.47Å |
| 155 | G | 78.9 | Confident | 78.4 | Confident | 8 Ų | 8 | 36.8 Ų | 36.8 | 8% | 0.082 | 18% | 0.183 | C | C | . | . | S | Bend | trans | 81.3 | 19 | 176.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | L10 G67 V68 S150 | L10-G155 VanDerWaalsContact CD1-CA 3.41Å; G67-G155 CarbonylContact C-O 3.02Å; V68-G155 WeakPolarHBondContact CA-O 2.98Å; V68-G155 PolarHBondContact N-O 3.37Å; S150-G155 WeakPolarHBondContact OG-CA 3.13Å; S150-G155 PolarHBondContact OG-N 3.48Å |
| 156 | W | 86.3 | Confident | 78.3 | Confident | 9 Ų | 9 | 39.1 Ų | 39.1 | 3% | 0.034 | 19% | 0.193 | C | C | . | . | S | Bend | trans | -135.6 | 156.8 | 177.4 | 59.9 | 72 | 0 | 0 | 0 | 110 | V18 Y64 V68 D148 S153 V154 N268 T269 | V18-W156 HydrophobicContact CG1-CZ3 4.03Å; Y64-W156 HydrophobicContact CD1-CB 4.3Å; Y64-W156 AromaticContact CD1-CD1 3.9Å; Y64-W156 AromaticContact CD1-CD2 3.36Å; Y64-W156 HydrophobicContact CD1-CD2 3.36Å; Y64-W156 AromaticContact CD1-CE2 3.6Å; Y64-W156 AromaticContact CD1-CE3 3.7Å; Y64-W156 HydrophobicContact CD1-CE3 3.7Å; Y64-W156 AromaticContact CD1-CG 3.62Å; Y64-W156 HydrophobicContact CD1-CG 3.62Å; Y64-W156 HydrophobicContact CD1-CH2 4.41Å; Y64-W156 HydrophobicContact CD1-CZ2 4.17Å; Y64-W156 HydrophobicContact CD1-CZ3 4.19Å; Y64-W156 AromaticContact CD1-NE1 3.89Å; Y64-W156 AromaticContact CE1-CD1 3.71Å; Y64-W156 AromaticContact CE1-CD2 3.73Å; Y64-W156 HydrophobicContact CE1-CD2 3.73Å; Y64-W156 AromaticContact CE1-CE2 3.45Å; Y64-W156 VanDerWaalsContact CE1-CE2 3.45Å; Y64-W156 HydrophobicContact CE1-CE3 4.39Å; Y64-W156 AromaticContact CE1-CG 3.93Å; Y64-W156 HydrophobicContact CE1-CG 3.93Å; Y64-W156 AromaticContact CE1-CZ2 3.96Å; Y64-W156 HydrophobicContact CE1-CZ2 3.96Å; Y64-W156 AromaticContact CE1-NE1 3.42Å; Y64-W156 HydrophobicContact CG-CD2 4.33Å; Y64-W156 HydrophobicContact CG-CE3 4.25Å; Y64-W156 HydrophobicContact CG-CZ3 4.46Å; V68-W156 HydrophobicContact CG2-CE3 3.81Å; V68-W156 HydrophobicContact CG2-CZ3 4.24Å; D148-W156 VanDerWaalsContact OD1-O 3.06Å; S153-W156 WeakPolarHBondContact CB-O 3.13Å; S153-W156 PolarHBondContact OG-O 2.91Å; V154-W156 HydrophobicContact CB-CE3 4.18Å; V154-W156 HydrophobicContact CB-CH2 3.57Å; V154-W156 HydrophobicContact CB-CZ2 4.13Å; V154-W156 HydrophobicContact CB-CZ3 3.61Å; V154-W156 HydrophobicContact CG1-CZ3 4.41Å; V154-W156 HydrophobicContact CG2-CH2 3.92Å; V154-W156 HydrophobicContact CG2-CZ2 4.28Å; V154-W156 HydrophobicContact CG2-CZ3 4.45Å; V154-W156 VanDerWaalsContact O-CZ3 3.28Å; V154-W156 WeakPolarHBondContact O-CZ3 3.17Å; W156-N268 HydrophobicContact CH2-CB 4.24Å; W156-N268 HydrophobicContact CZ2-CB 4.33Å; W156-T269 HydrophobicContact CZ3-CG2 4.29Å |
| 157 | C | 90.3 | Very high | 78.5 | Confident | 1 Ų | 1 | 41.2 Ų | 41.2 | 1% | 0.007 | 21% | 0.205 | C | C | . | . | trans | -76.6 | 147.4 | 179.7 | -65 | 0 | 0 | 0 | 0 | 112.2 | C79 Q82 G83 | C79-C157 WeakPolarHBondContact CA-SG 3.32Å; C79-C157 HydrophobicContact CB-CB 4.07Å; C79-C157 WeakPolarHBondContact CB-SG 3.43Å; C79-C157 VanDerWaalsContact O-CB 3.23Å; C79-C157 WeakPolarHBondContact O-CB 3.5Å; C79-C157 WeakPolarHBondContact SG-CB 3.3Å; C79-C157 CovalentContact SG-SG 2.02Å; C79-C157 PolarHBondContact SG-SG 3.34Å; Q82-C157 PolarHBondContact OE1-O 3.17Å; G83-C157 WeakPolarHBondContact CA-O 3.48Å | ||
| 158 | W | 90.7 | Very high | 79.2 | Confident | 28 Ų | 28 | 42.4 Ų | 42.4 | 11% | 0.106 | 22% | 0.216 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -147.8 | -114.2 | 174.8 | -171.8 | 42.1 | 0 | 0 | 0 | 111.7 | I145 G146 V152 M170 T173 K175 | I145-W158 CarbonylContact C-O 3.42Å; I145-W158 VanDerWaalsContact CA-O 3.22Å; I145-W158 WeakPolarHBondContact CA-O 3.25Å; I145-W158 WeakPolarHBondContact CG2-O 3.35Å; G146-W158 PolarHBondContact N-O 3.42Å; G146-W158 CarbonylContact O-C 3.57Å; G146-W158 PolarHBondContact O-N 2.98Å; V152-W158 HydrophobicContact CB-CE3 4.44Å; V152-W158 HydrophobicContact CB-CZ3 4.44Å; V152-W158 HydrophobicContact CG2-CE3 3.83Å; V152-W158 HydrophobicContact CG2-CZ3 4.21Å; W158-M170 HydrophobicContact CE3-CE 4.44Å; W158-M170 HydrophobicContact CE3-CG 4.39Å; W158-M170 VanDerWaalsContact CH2-CA 3.49Å; W158-M170 HydrophobicContact CH2-CB 3.48Å; W158-M170 VanDerWaalsContact CH2-CB 3.48Å; W158-M170 HydrophobicContact CH2-CE 4.2Å; W158-M170 HydrophobicContact CH2-CG 3.68Å; W158-M170 WeakPolarHBondContact CH2-O 3.39Å; W158-M170 HydrophobicContact CZ2-CB 4.21Å; W158-M170 HydrophobicContact CZ2-CG 4.45Å; W158-M170 WeakPolarHBondContact CZ2-O 3.45Å; W158-M170 HydrophobicContact CZ3-CB 3.97Å; W158-M170 HydrophobicContact CZ3-CE 3.54Å; W158-M170 HydrophobicContact CZ3-CG 3.65Å; W158-M170 HydrophobicContact CZ3-SD 4.48Å; W158-T173 WeakPolarHBondContact CZ2-OG1 3.41Å; W158-T173 PolarHBondContact NE1-OG1 3.13Å; W158-K175 HydrophobicContact CH2-CG 4.02Å |
| 159 | I | 90 | Very high | 80.1 | Confident | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -94.9 | 131.3 | -178.4 | -61.3 | -55.8 | 0 | 0 | 0 | 109.9 | K144 I145 D148 L161 H166 W169 M170 T173 | K144-I159 WeakPolarHBondContact O-CA 3.45Å; I145-I159 HydrophobicContact CG1-CD1 4.19Å; D148-I159 WeakPolarHBondContact CB-O 3.17Å; I159-L161 PolarHBondContact O-N 3.2Å; I159-H166 HydrophobicContact CG2-CB 4.25Å; I159-W169 HydrophobicContact CD1-CB 4.17Å; I159-W169 HydrophobicContact CG1-CB 4.43Å; I159-W169 HydrophobicContact CG2-CB 3.93Å; I159-M170 HydrophobicContact CB-CG 3.97Å; I159-M170 HydrophobicContact CG1-CG 4.15Å; I159-M170 HydrophobicContact CG2-CG 4.05Å; I159-T173 HydrophobicContact CD1-CG2 3.91Å |
| 160 | D | 82.4 | Confident | 81.3 | Confident | 47 Ų | 47 | 42.7 Ų | 42.7 | 25% | 0.251 | 21% | 0.213 | S | C | . | . | trans | -62.5 | 118.3 | 174.4 | -178 | -2.7 | 0 | 0 | 0 | 110.4 | K144 E162 A163 H166 | K144-D160 PolarHBondContact O-N 3.12Å; D160-E162 VanDerWaalsContact C-N 3.32Å; D160-E162 WeakPolarHBondContact OD1-CB 3.31Å; D160-E162 PolarHBondContact OD1-N 3.06Å; D160-A163 WeakPolarHBondContact O-CB 3.48Å; D160-H166 WeakPolarHBondContact O-CB 3.45Å | ||
| 161 | L | 77.6 | Confident | 82.7 | Confident | 49 Ų | 49 | 44.5 Ų | 44.5 | 26% | 0.257 | 22% | 0.221 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -16.3 | -177.8 | -62.5 | 178.4 | 0 | 0 | 0 | 112.8 | D148 D151 V152 I159 A163 M170 | D148-L161 HydrophobicContact CB-CD1 4.5Å; D148-L161 HydrophobicContact CB-CG 4.37Å; D151-L161 HydrophobicContact CB-CD1 3.81Å; V152-L161 HydrophobicContact CG1-CD2 4.24Å; V152-L161 HydrophobicContact CG2-CD1 4.41Å; V152-L161 HydrophobicContact CG2-CD2 4.05Å; I159-L161 PolarHBondContact O-N 3.2Å; L161-A163 PolarHBondContact O-N 2.8Å; L161-M170 HydrophobicContact CD2-SD 4.26Å |
| 162 | E | 75.9 | Confident | 84.3 | Confident | 179 Ų | 179 | 45.6 Ų | 45.6 | 84% | 0.836 | 23% | 0.226 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -75 | -17 | 175.8 | -59.9 | -165.2 | 159.6 | 0 | 0 | 112.2 | D160 K164 | D160-E162 VanDerWaalsContact C-N 3.32Å; D160-E162 WeakPolarHBondContact OD1-CB 3.31Å; D160-E162 PolarHBondContact OD1-N 3.06Å; E162-K164 PolarHBondContact O-N 2.96Å |
| 163 | A | 79.6 | Confident | 85.9 | Confident | 16 Ų | 16 | 45.1 Ų | 45.1 | 13% | 0.132 | 22% | 0.223 | C | C | . | . | S | Bend | trans | -67.1 | 130.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | K144 D160 L161 D165 H166 | K144-A163 HydrophobicContact CD-CB 4.47Å; D160-A163 WeakPolarHBondContact O-CB 3.48Å; L161-A163 PolarHBondContact O-N 2.8Å; A163-D165 PolarHBondContact O-N 3.39Å; A163-D165 VanDerWaalsContact O-N 3.12Å; A163-H166 HydrophobicContact CB-CB 4.44Å; A163-H166 VanDerWaalsContact O-CB 3.31Å; A163-H166 WeakPolarHBondContact O-CB 3.19Å; A163-H166 PolarHBondContact O-N 3.47Å; A163-H166 PolarHBondContact O-ND1 3.45Å |
| 164 | K | 82.7 | Confident | 86.9 | Confident | 216 Ų | 216 | 45.3 Ų | 45.3 | 94% | 0.939 | 23% | 0.226 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -58 | -29.9 | 178.7 | -69.1 | -177.2 | 179.8 | 177.6 | 0 | 113.6 | E162 | E162-K164 PolarHBondContact O-N 2.96Š|
| 165 | D | 88.6 | Confident | 87.7 | Confident | 55 Ų | 55 | 46 Ų | 46 | 29% | 0.294 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -100.6 | 18.9 | -179.5 | 57.7 | -27.5 | 0 | 0 | 0 | 112.8 | K144 A163 V167 L168 W169 | K144-D165 WeakPolarHBondContact CE-OD2 3.33Å; K144-D165 VanDerWaalsContact NZ-CG 3.25Å; K144-D165 IonicContact NZ-OD1 2.7Å; K144-D165 PolarHBondContact NZ-OD1 3.4Å; K144-D165 IonicContact NZ-OD2 2.98Å; K144-D165 PolarHBondContact NZ-OD2 2.86Å; A163-D165 PolarHBondContact O-N 3.39Å; A163-D165 VanDerWaalsContact O-N 3.12Å; D165-V167 VanDerWaalsContact C-N 3.29Å; D165-V167 PolarHBondContact O-N 3.2Å; D165-L168 WeakPolarHBondContact O-CB 3.46Å; D165-L168 PolarHBondContact O-N 2.99Å; D165-W169 PolarHBondContact O-N 3.34Å; D165-W169 VanDerWaalsContact OD2-CD1 3.26Å; D165-W169 PolarHBondContact OD2-NE1 2.97Å |
| 166 | H | 86.6 | Confident | 88.5 | Confident | 56 Ų | 56 | 48.8 Ų | 48.8 | 26% | 0.259 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -51.5 | -44.4 | -178.2 | 62.6 | -86.1 | 0 | 0 | 0 | 112.4 | I159 D160 A163 L168 W169 M170 | I159-H166 HydrophobicContact CG2-CB 4.25Å; D160-H166 WeakPolarHBondContact O-CB 3.45Å; A163-H166 HydrophobicContact CB-CB 4.44Å; A163-H166 VanDerWaalsContact O-CB 3.31Å; A163-H166 WeakPolarHBondContact O-CB 3.19Å; A163-H166 PolarHBondContact O-N 3.47Å; A163-H166 PolarHBondContact O-ND1 3.45Å; H166-L168 VanDerWaalsContact C-N 3.31Å; H166-L168 PolarHBondContact O-N 3.12Å; H166-W169 CarbonylContact O-C 3.54Å; H166-W169 PolarHBondContact O-N 2.77Å; H166-W169 VanDerWaalsContact O-N 3.1Å; H166-M170 WeakPolarHBondContact O-CB 3.49Å; H166-M170 WeakPolarHBondContact O-CG 3.36Å; H166-M170 PolarHBondContact O-N 2.69Å |
| 167 | V | 89.1 | Confident | 88.9 | Confident | 51 Ų | 51 | 51.1 Ų | 51.1 | 31% | 0.309 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -58.9 | -41.7 | 179.1 | -177 | 0 | 0 | 0 | 0 | 111.9 | D165 W169 M170 L171 L249 | D165-V167 VanDerWaalsContact C-N 3.29Å; D165-V167 PolarHBondContact O-N 3.2Å; V167-W169 VanDerWaalsContact C-N 3.34Å; V167-W169 PolarHBondContact O-N 2.8Å; V167-M170 PolarHBondContact O-N 2.95Å; V167-L171 HydrophobicContact CG1-CD1 4.26Å; V167-L171 VanDerWaalsContact O-CG 3.27Å; V167-L171 WeakPolarHBondContact O-CG 3.46Å; V167-L171 PolarHBondContact O-N 3.32Å; V167-L249 HydrophobicContact CG1-CD2 4.3Å; V167-L249 HydrophobicContact CG2-CD2 4.11Å |
| 168 | L | 92.6 | Very high | 89.1 | Confident | 91 Ų | 91 | 51.2 Ų | 51.2 | 48% | 0.476 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -62.1 | -45.1 | 177.3 | 175.3 | 64.7 | 0 | 0 | 0 | 110.6 | D165 H166 L171 L172 | D165-L168 WeakPolarHBondContact O-CB 3.46Å; D165-L168 PolarHBondContact O-N 2.99Å; H166-L168 VanDerWaalsContact C-N 3.31Å; H166-L168 PolarHBondContact O-N 3.12Å; L168-L171 WeakPolarHBondContact O-CB 3.41Å; L168-L171 PolarHBondContact O-N 3.47Å; L168-L172 HydrophobicContact CD1-CD1 3.97Å; L168-L172 HydrophobicContact CD1-CG 4.15Å; L168-L172 HydrophobicContact CG-CD1 3.95Å; L168-L172 HydrophobicContact CG-CG 4.46Å; L168-L172 WeakPolarHBondContact O-CB 3.5Å; L168-L172 WeakPolarHBondContact O-CG 3.37Å; L168-L172 PolarHBondContact O-N 3.03Å |
| 169 | W | 92.8 | Very high | 89.2 | Confident | 23 Ų | 23 | 53 Ų | 53 | 9% | 0.087 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -69 | -36.5 | 178.7 | -73.7 | 101.1 | 0 | 0 | 0 | 112.5 | A138 A139 L142 K144 I159 D165 H166 V167 L171 L172 T173 | A138-W169 HydrophobicContact CB-CH2 4.25Å; A138-W169 HydrophobicContact CB-CZ3 4.48Å; A139-W169 HydrophobicContact CB-CE3 3.74Å; A139-W169 HydrophobicContact CB-CZ3 3.68Å; L142-W169 HydrophobicContact CB-CZ2 4.5Å; L142-W169 HydrophobicContact CD1-CH2 3.62Å; L142-W169 HydrophobicContact CD1-CZ2 3.41Å; L142-W169 VanDerWaalsContact CD1-CZ2 3.41Å; K144-W169 HydrophobicContact CB-CB 4.4Å; K144-W169 HydrophobicContact CB-CD2 3.91Å; K144-W169 HydrophobicContact CB-CE3 4.34Å; K144-W169 HydrophobicContact CB-CG 3.88Å; K144-W169 HydrophobicContact CD-CD2 4.44Å; K144-W169 HydrophobicContact CD-CG 4.22Å; K144-W169 HydrophobicContact CG-CD2 3.73Å; K144-W169 HydrophobicContact CG-CE3 4.39Å; K144-W169 HydrophobicContact CG-CG 3.9Å; K144-W169 HydrophobicContact CG-CZ2 4.1Å; I159-W169 HydrophobicContact CD1-CB 4.17Å; I159-W169 HydrophobicContact CG1-CB 4.43Å; I159-W169 HydrophobicContact CG2-CB 3.93Å; D165-W169 PolarHBondContact O-N 3.34Å; D165-W169 VanDerWaalsContact OD2-CD1 3.26Å; D165-W169 PolarHBondContact OD2-NE1 2.97Å; H166-W169 CarbonylContact O-C 3.54Å; H166-W169 PolarHBondContact O-N 2.77Å; H166-W169 VanDerWaalsContact O-N 3.1Å; V167-W169 VanDerWaalsContact C-N 3.34Å; V167-W169 PolarHBondContact O-N 2.8Å; W169-L171 VanDerWaalsContact C-N 3.29Å; W169-L171 PolarHBondContact O-N 3.38Å; W169-L172 PolarHBondContact O-N 3.31Å; W169-T173 HydrophobicContact CE3-CG2 4.07Å; W169-T173 VanDerWaalsContact O-CB 3.25Å; W169-T173 WeakPolarHBondContact O-CB 3.23Å; W169-T173 VanDerWaalsContact O-CG2 3.29Å; W169-T173 WeakPolarHBondContact O-CG2 3.3Å; W169-T173 PolarHBondContact O-N 3.35Å; W169-T173 PolarHBondContact O-OG1 3.31Å |
| 170 | M | 91.8 | Very high | 89.4 | Confident | 4 Ų | 4 | 56.3 Ų | 56.3 | 2% | 0.02 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.9 | -39.3 | 172.7 | -69 | 170.1 | 84.5 | 0 | 0 | 111.7 | V152 W158 I159 L161 H166 V167 G174 K175 F245 | V152-M170 HydrophobicContact CB-CE 3.82Å; V152-M170 HydrophobicContact CG1-CE 3.52Å; V152-M170 HydrophobicContact CG2-CE 4.05Å; W158-M170 HydrophobicContact CE3-CE 4.44Å; W158-M170 HydrophobicContact CE3-CG 4.39Å; W158-M170 VanDerWaalsContact CH2-CA 3.49Å; W158-M170 HydrophobicContact CH2-CB 3.48Å; W158-M170 VanDerWaalsContact CH2-CB 3.48Å; W158-M170 HydrophobicContact CH2-CE 4.2Å; W158-M170 HydrophobicContact CH2-CG 3.68Å; W158-M170 WeakPolarHBondContact CH2-O 3.39Å; W158-M170 HydrophobicContact CZ2-CB 4.21Å; W158-M170 HydrophobicContact CZ2-CG 4.45Å; W158-M170 WeakPolarHBondContact CZ2-O 3.45Å; W158-M170 HydrophobicContact CZ3-CB 3.97Å; W158-M170 HydrophobicContact CZ3-CE 3.54Å; W158-M170 HydrophobicContact CZ3-CG 3.65Å; W158-M170 HydrophobicContact CZ3-SD 4.48Å; I159-M170 HydrophobicContact CB-CG 3.97Å; I159-M170 HydrophobicContact CG1-CG 4.15Å; I159-M170 HydrophobicContact CG2-CG 4.05Å; L161-M170 HydrophobicContact CD2-SD 4.26Å; H166-M170 WeakPolarHBondContact O-CB 3.49Å; H166-M170 WeakPolarHBondContact O-CG 3.36Å; H166-M170 PolarHBondContact O-N 2.69Å; V167-M170 PolarHBondContact O-N 2.95Å; M170-G174 PolarHBondContact O-N 3.45Å; M170-K175 WeakPolarHBondContact O-CB 3.43Å; M170-K175 PolarHBondContact O-N 3.28Å; M170-F245 HydrophobicContact CB-CE2 3.99Å; M170-F245 HydrophobicContact CE-CD2 3.48Å; M170-F245 VanDerWaalsContact CE-CD2 3.48Å; M170-F245 HydrophobicContact CE-CE2 3.42Å; M170-F245 VanDerWaalsContact CE-CE2 3.42Å; M170-F245 HydrophobicContact SD-CE2 4.04Å |
| 171 | L | 93.5 | Very high | 90 | Very high | 55 Ų | 55 | 54.1 Ų | 54.1 | 29% | 0.288 | 27% | 0.267 | S | S | . | . | I | π-helix | trans | -66.4 | -54.4 | 173.9 | -69 | 171.8 | 0 | 0 | 0 | 111.2 | V167 L168 W169 T173 G174 K175 L176 F245 | V167-L171 HydrophobicContact CG1-CD1 4.26Å; V167-L171 VanDerWaalsContact O-CG 3.27Å; V167-L171 WeakPolarHBondContact O-CG 3.46Å; V167-L171 PolarHBondContact O-N 3.32Å; L168-L171 WeakPolarHBondContact O-CB 3.41Å; L168-L171 PolarHBondContact O-N 3.47Å; W169-L171 VanDerWaalsContact C-N 3.29Å; W169-L171 PolarHBondContact O-N 3.38Å; L171-T173 PolarHBondContact O-N 3.47Å; L171-G174 PolarHBondContact O-N 3.34Å; L171-K175 HydrophobicContact CD2-CB 4.02Å; L171-K175 PolarHBondContact O-N 3Å; L171-L176 HydrophobicContact CB-CB 4.36Å; L171-L176 WeakPolarHBondContact O-CB 3.09Å; L171-L176 PolarHBondContact O-N 3.42Å; L171-F245 HydrophobicContact CD2-CE1 4.33Å; L171-F245 HydrophobicContact CD2-CZ 4.15Å |
| 172 | L | 93.9 | Very high | 90.7 | Very high | 56 Ų | 56 | 54 Ų | 54 | 29% | 0.293 | 26% | 0.264 | S | S | . | . | I | π-helix | trans | -64.7 | -38.5 | -175.6 | -71.6 | 176.4 | 0 | 0 | 0 | 113.4 | I135 L168 W169 G174 W177 | I135-L172 WeakPolarHBondContact CG2-O 3.44Å; L168-L172 HydrophobicContact CD1-CD1 3.97Å; L168-L172 HydrophobicContact CD1-CG 4.15Å; L168-L172 HydrophobicContact CG-CD1 3.95Å; L168-L172 HydrophobicContact CG-CG 4.46Å; L168-L172 WeakPolarHBondContact O-CB 3.5Å; L168-L172 WeakPolarHBondContact O-CG 3.37Å; L168-L172 PolarHBondContact O-N 3.03Å; W169-L172 PolarHBondContact O-N 3.31Å; L172-G174 VanDerWaalsContact C-N 3.3Å; L172-G174 PolarHBondContact O-N 3.24Å; L172-W177 PolarHBondContact O-NE1 3.28Å |
| 173 | T | 93.1 | Very high | 91.5 | Very high | 2 Ų | 2 | 51 Ų | 51 | 1% | 0.012 | 25% | 0.252 | C | S | . | . | I | π-helix | trans | -85.5 | 1.1 | -176.8 | 63.1 | 0 | 0 | 0 | 0 | 113.9 | T87 T91 I135 A139 W158 I159 W169 L171 | T87-T173 HydrophobicContact CG2-CG2 4.12Å; T91-T173 PolarHBondContact OG1-O 3.26Å; I135-T173 HydrophobicContact CG2-CG2 3.89Å; A139-T173 HydrophobicContact CB-CG2 3.96Å; W158-T173 WeakPolarHBondContact CZ2-OG1 3.41Å; W158-T173 PolarHBondContact NE1-OG1 3.13Å; I159-T173 HydrophobicContact CD1-CG2 3.91Å; W169-T173 HydrophobicContact CE3-CG2 4.07Å; W169-T173 VanDerWaalsContact O-CB 3.25Å; W169-T173 WeakPolarHBondContact O-CB 3.23Å; W169-T173 VanDerWaalsContact O-CG2 3.29Å; W169-T173 WeakPolarHBondContact O-CG2 3.3Å; W169-T173 PolarHBondContact O-N 3.35Å; W169-T173 PolarHBondContact O-OG1 3.31Å; L171-T173 PolarHBondContact O-N 3.47Å |
| 174 | G | 92.7 | Very high | 92.1 | Very high | 6 Ų | 6 | 53.8 Ų | 53.8 | 6% | 0.062 | 26% | 0.264 | C | S | . | . | I | π-helix | trans | -179.9 | -55.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | M170 L171 L172 L176 W177 E178 | M170-G174 PolarHBondContact O-N 3.45Å; L171-G174 PolarHBondContact O-N 3.34Å; L172-G174 VanDerWaalsContact C-N 3.3Å; L172-G174 PolarHBondContact O-N 3.24Å; G174-L176 VanDerWaalsContact C-N 3.34Å; G174-L176 PolarHBondContact O-N 3.35Å; G174-W177 PolarHBondContact O-N 3.49Å; G174-E178 PolarHBondContact O-N 2.98Å |
| 175 | K | 93.3 | Very high | 92.6 | Very high | 13 Ų | 13 | 43.5 Ų | 43.5 | 6% | 0.057 | 22% | 0.219 | C | C | . | . | I | π-helix | trans | -63.3 | -35.9 | -163.8 | -67 | -74.4 | 159.2 | -167.4 | 0 | 113.8 | W158 M170 L171 E178 M179 S241 F245 | W158-K175 HydrophobicContact CH2-CG 4.02Å; M170-K175 WeakPolarHBondContact O-CB 3.43Å; M170-K175 PolarHBondContact O-N 3.28Å; L171-K175 HydrophobicContact CD2-CB 4.02Å; L171-K175 PolarHBondContact O-N 3Å; K175-E178 WeakPolarHBondContact CD-OE2 3.49Å; K175-E178 IonicContact NZ-OE2 2.8Å; K175-E178 PolarHBondContact NZ-OE2 3.1Å; K175-E178 PolarHBondContact O-N 3.34Å; K175-M179 VanDerWaalsContact O-CG 3.26Å; K175-M179 WeakPolarHBondContact O-CG 3.45Å; K175-M179 PolarHBondContact O-N 3.32Å; K175-S241 PolarHBondContact NZ-O 2.81Å; K175-S241 PolarHBondContact NZ-OG 2.99Å; K175-F245 HydrophobicContact CB-CE1 4.28Å; K175-F245 HydrophobicContact CB-CZ 4.37Å; K175-F245 HydrophobicContact CD-CB 3.95Å; K175-F245 HydrophobicContact CD-CD1 3.91Å; K175-F245 HydrophobicContact CD-CD2 4.14Å; K175-F245 HydrophobicContact CD-CE1 4.43Å; K175-F245 HydrophobicContact CD-CG 3.73Å; K175-F245 HydrophobicContact CG-CD1 4.15Å; K175-F245 HydrophobicContact CG-CD2 4.01Å; K175-F245 HydrophobicContact CG-CE1 4.22Å; K175-F245 HydrophobicContact CG-CE2 4.08Å; K175-F245 HydrophobicContact CG-CG 4.03Å; K175-F245 HydrophobicContact CG-CZ 4.17Å |
| 176 | L | 94.9 | Very high | 92.7 | Very high | 68 Ų | 68 | 43.1 Ų | 43.1 | 36% | 0.356 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -60.2 | -47.6 | 174.3 | 177.6 | 61.9 | 0 | 0 | 0 | 111.1 | L171 G174 M179 L180 | L171-L176 HydrophobicContact CB-CB 4.36Å; L171-L176 WeakPolarHBondContact O-CB 3.09Å; L171-L176 PolarHBondContact O-N 3.42Å; G174-L176 VanDerWaalsContact C-N 3.34Å; G174-L176 PolarHBondContact O-N 3.35Å; L176-M179 PolarHBondContact O-N 3.16Å; L176-L180 HydrophobicContact CD1-CD1 4.26Å; L176-L180 HydrophobicContact CD1-CG 4.38Å; L176-L180 HydrophobicContact CG-CD1 4.11Å; L176-L180 WeakPolarHBondContact O-CB 3.4Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.44Å; L176-L180 PolarHBondContact O-N 3.04Å |
| 177 | W | 95.5 | Very high | 92.9 | Very high | 58 Ų | 58 | 44.7 Ų | 44.7 | 22% | 0.22 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -69.6 | -37.1 | -177.4 | -51.9 | 109.1 | 0 | 0 | 0 | 112.2 | T91 F94 F95 I131 I135 L172 G174 L180 A181 | T91-W177 HydrophobicContact CG2-CG 4.28Å; F94-W177 HydrophobicContact CD2-CB 4.14Å; F95-W177 HydrophobicContact CE1-CE3 4.08Å; F95-W177 HydrophobicContact CE1-CZ3 4.06Å; F95-W177 HydrophobicContact CE2-CB 4.33Å; F95-W177 AromaticContact CE2-CD2 3.63Å; F95-W177 HydrophobicContact CE2-CD2 3.63Å; F95-W177 AromaticContact CE2-CE3 3.81Å; F95-W177 HydrophobicContact CE2-CE3 3.81Å; F95-W177 AromaticContact CE2-CG 3.86Å; F95-W177 HydrophobicContact CE2-CG 3.86Å; F95-W177 HydrophobicContact CE2-CZ3 4.39Å; F95-W177 AromaticContact CZ-CD2 3.55Å; F95-W177 HydrophobicContact CZ-CD2 3.55Å; F95-W177 AromaticContact CZ-CE2 3.93Å; F95-W177 AromaticContact CZ-CE3 3.29Å; F95-W177 HydrophobicContact CZ-CE3 3.29Å; F95-W177 HydrophobicContact CZ-CG 4.27Å; F95-W177 AromaticContact CZ-CH2 3.86Å; F95-W177 HydrophobicContact CZ-CH2 3.86Å; F95-W177 HydrophobicContact CZ-CZ2 4.09Å; F95-W177 AromaticContact CZ-CZ3 3.47Å; F95-W177 HydrophobicContact CZ-CZ3 3.47Å; F95-W177 VanDerWaalsContact CZ-CZ3 3.47Å; I131-W177 HydrophobicContact CG2-CH2 4.37Å; I131-W177 HydrophobicContact CG2-CZ2 4.21Å; I135-W177 HydrophobicContact CD1-CZ2 3.7Å; L172-W177 PolarHBondContact O-NE1 3.28Å; G174-W177 PolarHBondContact O-N 3.49Å; W177-L180 HydrophobicContact CE3-CD1 4.01Å; W177-L180 HydrophobicContact CZ3-CD1 4.25Å; W177-L180 PolarHBondContact O-N 2.9Å; W177-A181 WeakPolarHBondContact O-CB 3.23Å; W177-A181 PolarHBondContact O-N 2.93Å |
| 178 | E | 94.1 | Very high | 93 | Very high | 3 Ų | 3 | 43 Ų | 43 | 1% | 0.014 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -59.1 | -50.3 | 172.1 | 178.6 | 169.3 | -108.6 | 0 | 0 | 111.2 | F94 G174 K175 A181 Y182 R238 T242 | F94-E178 HydrophobicContact CE1-CB 4.46Å; F94-E178 HydrophobicContact CE2-CB 4.02Å; F94-E178 HydrophobicContact CZ-CB 3.91Å; F94-E178 HydrophobicContact CZ-CG 4.29Å; G174-E178 PolarHBondContact O-N 2.98Å; K175-E178 WeakPolarHBondContact CD-OE2 3.49Å; K175-E178 IonicContact NZ-OE2 2.8Å; K175-E178 PolarHBondContact NZ-OE2 3.1Å; K175-E178 PolarHBondContact O-N 3.34Å; E178-A181 WeakPolarHBondContact O-CB 3.49Å; E178-A181 PolarHBondContact O-N 2.8Å; E178-Y182 HydrophobicContact CG-CE1 3.97Å; E178-Y182 HydrophobicContact CG-CE2 4.16Å; E178-Y182 WeakPolarHBondContact CG-OH 3.31Å; E178-Y182 WeakPolarHBondContact O-CD1 3.18Å; E178-Y182 PolarHBondContact O-N 3.49Å; E178-Y182 VanDerWaalsContact O-N 3.09Å; E178-R238 WeakPolarHBondContact OE1-CB 3.36Å; E178-T242 PolarHBondContact OE2-OG1 2.96Å |
| 179 | M | 93.2 | Very high | 92.7 | Very high | 65 Ų | 65 | 41.1 Ų | 41.1 | 32% | 0.32 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -65 | -40.5 | 178.3 | -68.7 | 176.5 | -173 | 0 | 0 | 112.4 | K175 L176 A181 Y182 I183 T242 F245 | K175-M179 VanDerWaalsContact O-CG 3.26Å; K175-M179 WeakPolarHBondContact O-CG 3.45Å; K175-M179 PolarHBondContact O-N 3.32Å; L176-M179 PolarHBondContact O-N 3.16Å; M179-A181 VanDerWaalsContact C-N 3.29Å; M179-A181 PolarHBondContact O-N 2.94Å; M179-Y182 WeakPolarHBondContact O-CB 3.46Å; M179-Y182 PolarHBondContact O-N 3.15Å; M179-Y182 VanDerWaalsContact O-N 3.16Å; M179-I183 PolarHBondContact O-N 3.41Å; M179-T242 HydrophobicContact CE-CG2 4.29Å; M179-F245 HydrophobicContact CE-CD1 4.11Å; M179-F245 HydrophobicContact CE-CE1 4.02Å |
| 180 | L | 94.8 | Very high | 92.4 | Very high | 70 Ų | 70 | 45.1 Ų | 45.1 | 37% | 0.366 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -61 | -39.8 | 174.1 | -74 | 173.6 | 0 | 0 | 0 | 111.3 | L176 W177 Y182 I183 L184 | L176-L180 HydrophobicContact CD1-CD1 4.26Å; L176-L180 HydrophobicContact CD1-CG 4.38Å; L176-L180 HydrophobicContact CG-CD1 4.11Å; L176-L180 WeakPolarHBondContact O-CB 3.4Å; L176-L180 VanDerWaalsContact O-CG 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.44Å; L176-L180 PolarHBondContact O-N 3.04Å; W177-L180 HydrophobicContact CE3-CD1 4.01Å; W177-L180 HydrophobicContact CZ3-CD1 4.25Å; W177-L180 PolarHBondContact O-N 2.9Å; L180-Y182 VanDerWaalsContact C-N 3.32Å; L180-Y182 PolarHBondContact O-N 2.74Å; L180-I183 PolarHBondContact O-N 2.73Å; L180-I183 VanDerWaalsContact O-N 3.15Å; L180-L184 WeakPolarHBondContact O-CB 3.38Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 3.25Å |
| 181 | A | 94.2 | Very high | 92.3 | Very high | 1 Ų | 1 | 48.1 Ų | 48.1 | 1% | 0.008 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63.3 | -36.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | V98 W177 E178 M179 I183 L184 L185 F234 | V98-A181 HydrophobicContact CG2-CB 3.95Å; W177-A181 WeakPolarHBondContact O-CB 3.23Å; W177-A181 PolarHBondContact O-N 2.93Å; E178-A181 WeakPolarHBondContact O-CB 3.49Å; E178-A181 PolarHBondContact O-N 2.8Å; M179-A181 VanDerWaalsContact C-N 3.29Å; M179-A181 PolarHBondContact O-N 2.94Å; A181-I183 PolarHBondContact O-N 2.86Å; A181-L184 PolarHBondContact O-N 3.04Å; A181-L185 HydrophobicContact CB-CD1 4.01Å; A181-L185 HydrophobicContact CB-CG 4.33Å; A181-L185 WeakPolarHBondContact O-CB 3.48Å; A181-L185 WeakPolarHBondContact O-CG 3.3Å; A181-L185 PolarHBondContact O-N 3.41Å; A181-F234 HydrophobicContact CB-CE1 3.7Å; A181-F234 HydrophobicContact CB-CZ 4.15Å |
| 182 | Y | 92.2 | Very high | 91.9 | Very high | 47 Ų | 47 | 45.9 Ų | 45.9 | 18% | 0.184 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.9 | -23.3 | 174.8 | -64 | -12.5 | 0 | 0 | 0 | 113.8 | E178 M179 L180 P186 F234 I235 R238 V239 T242 | E178-Y182 HydrophobicContact CG-CE1 3.97Å; E178-Y182 HydrophobicContact CG-CE2 4.16Å; E178-Y182 WeakPolarHBondContact CG-OH 3.31Å; E178-Y182 WeakPolarHBondContact O-CD1 3.18Å; E178-Y182 PolarHBondContact O-N 3.49Å; E178-Y182 VanDerWaalsContact O-N 3.09Å; M179-Y182 WeakPolarHBondContact O-CB 3.46Å; M179-Y182 PolarHBondContact O-N 3.15Å; M179-Y182 VanDerWaalsContact O-N 3.16Å; L180-Y182 VanDerWaalsContact C-N 3.32Å; L180-Y182 PolarHBondContact O-N 2.74Å; Y182-P186 WeakPolarHBondContact O-CD 3.42Å; Y182-P186 WeakPolarHBondContact O-CG 3.39Å; Y182-F234 HydrophobicContact CD1-CE1 4.12Å; Y182-F234 HydrophobicContact CE1-CD1 4.37Å; Y182-F234 AromaticContact CE1-CE1 3.91Å; Y182-F234 HydrophobicContact CE1-CE1 3.91Å; Y182-I235 HydrophobicContact CD1-CG1 3.89Å; Y182-I235 HydrophobicContact CE1-CG1 4.39Å; Y182-R238 HydrophobicContact CE1-CB 3.92Å; Y182-R238 WeakPolarHBondContact OH-CB 2.98Å; Y182-R238 PolarHBondContact OH-O 2.94Å; Y182-R238 VanDerWaalsContact OH-O 3.08Å; Y182-V239 WeakPolarHBondContact OH-CA 3.39Å; Y182-V239 PolarHBondContact OH-N 3.24Å; Y182-T242 HydrophobicContact CE2-CG2 4.42Å; Y182-T242 WeakPolarHBondContact CE2-OG1 3.48Å; Y182-T242 PolarHBondContact OH-OG1 3.27Å |
| 183 | I | 92.4 | Very high | 91.4 | Very high | 114 Ų | 114 | 49.5 Ų | 49.5 | 59% | 0.585 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -93.6 | -49.5 | 177.5 | -58.3 | 172.3 | 0 | 0 | 0 | 110.2 | M179 L180 A181 P186 L187 | M179-I183 PolarHBondContact O-N 3.41Å; L180-I183 PolarHBondContact O-N 2.73Å; L180-I183 VanDerWaalsContact O-N 3.15Å; A181-I183 PolarHBondContact O-N 2.86Å; I183-P186 WeakPolarHBondContact O-CD 3.4Å; I183-L187 WeakPolarHBondContact O-CB 3.42Å; I183-L187 PolarHBondContact O-N 3.23Å |
| 184 | L | 93.5 | Very high | 91.1 | Very high | 76 Ų | 76 | 54.8 Ų | 54.8 | 40% | 0.398 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -66.7 | -41.6 | -174.7 | -68.5 | 175.9 | 0 | 0 | 0 | 112.4 | V98 L180 A181 L187 L188 | V98-L184 HydrophobicContact CG1-CD1 4.25Å; L180-L184 WeakPolarHBondContact O-CB 3.38Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 3.25Å; A181-L184 PolarHBondContact O-N 3.04Å; L184-L187 PolarHBondContact O-N 3.45Å; L184-L188 WeakPolarHBondContact O-CB 3.33Å; L184-L188 VanDerWaalsContact O-CG 3.27Å; L184-L188 WeakPolarHBondContact O-CG 3.42Å; L184-L188 PolarHBondContact O-N 2.89Å |
| 185 | L | 92.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -66.7 | -48.1 | -175.4 | -61.7 | 173.2 | 0 | 0 | 0 | 112.3 | T97 V98 A101 A181 L187 L188 Y189 P231 F234 | T97-L185 HydrophobicContact CG2-CD1 3.87Å; T97-L185 HydrophobicContact CG2-CD2 4.17Å; V98-L185 HydrophobicContact CB-CD2 4.44Å; V98-L185 HydrophobicContact CG2-CD2 3.99Å; V98-L185 HydrophobicContact CG2-CG 4.28Å; A101-L185 HydrophobicContact CB-CD2 3.55Å; A181-L185 HydrophobicContact CB-CD1 4.01Å; A181-L185 HydrophobicContact CB-CG 4.33Å; A181-L185 WeakPolarHBondContact O-CB 3.48Å; A181-L185 WeakPolarHBondContact O-CG 3.3Å; A181-L185 PolarHBondContact O-N 3.41Å; L185-L187 PolarHBondContact O-N 3.23Å; L185-L188 PolarHBondContact O-N 3.04Å; L185-Y189 VanDerWaalsContact O-CB 3.32Å; L185-Y189 WeakPolarHBondContact O-CB 3.25Å; L185-Y189 PolarHBondContact O-N 3.31Å; L185-P231 HydrophobicContact CB-CB 3.87Å; L185-P231 HydrophobicContact CB-CG 4.22Å; L185-P231 HydrophobicContact CD2-CG 4.47Å; L185-F234 HydrophobicContact CD1-CB 4.39Å; L185-F234 HydrophobicContact CD1-CD1 3.5Å; L185-F234 HydrophobicContact CD1-CE1 4.02Å; L185-F234 HydrophobicContact CD1-CG 4.03Å |
| 186 | P | 90 | Very high | 90.3 | Very high | 46 Ų | 46 | 60.7 Ų | 60.7 | 30% | 0.299 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -62.4 | -39.6 | 173.1 | -26.6 | 38.8 | 0 | 0 | 0 | 113.2 | Y182 I183 Y189 L190 I235 | Y182-P186 WeakPolarHBondContact O-CD 3.42Å; Y182-P186 WeakPolarHBondContact O-CG 3.39Å; I183-P186 WeakPolarHBondContact O-CD 3.4Å; P186-Y189 WeakPolarHBondContact O-CB 3.47Å; P186-Y189 PolarHBondContact O-N 2.94Å; P186-L190 WeakPolarHBondContact O-CB 3.22Å; P186-L190 VanDerWaalsContact O-CG 3.29Å; P186-L190 WeakPolarHBondContact O-CG 3.38Å; P186-L190 PolarHBondContact O-N 3.29Å; P186-I235 HydrophobicContact CG-CD1 3.61Å |
| 187 | L | 91.8 | Very high | 89.7 | Confident | 90 Ų | 90 | 61.6 Ų | 61.6 | 47% | 0.471 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -60.1 | -50 | 178 | 179.2 | 137.4 | 0 | 0 | 0 | 111.2 | I183 L184 L185 Y189 L190 L191 | I183-L187 WeakPolarHBondContact O-CB 3.42Å; I183-L187 PolarHBondContact O-N 3.23Å; L184-L187 PolarHBondContact O-N 3.45Å; L185-L187 PolarHBondContact O-N 3.23Å; L187-Y189 VanDerWaalsContact C-N 3.32Å; L187-Y189 PolarHBondContact O-N 3.09Å; L187-L190 PolarHBondContact O-N 3.12Å; L187-L191 HydrophobicContact CD2-CD1 3.75Å; L187-L191 HydrophobicContact CG-CD1 4.39Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.1Å; L187-L191 PolarHBondContact O-N 3.37Å |
| 188 | L | 90.6 | Very high | 89.2 | Confident | 16 Ų | 16 | 66.5 Ų | 66.5 | 8% | 0.084 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.2 | -40.8 | 176.9 | -69.1 | 171.4 | 0 | 0 | 0 | 111.6 | A101 F102 Y105 L184 L185 L191 V192 | A101-L188 HydrophobicContact CB-CD1 3.96Å; F102-L188 HydrophobicContact CB-CD1 4.2Å; F102-L188 HydrophobicContact CD2-CD2 4.16Å; Y105-L188 HydrophobicContact CD1-CD2 4.14Å; Y105-L188 HydrophobicContact CD2-CD2 4.39Å; Y105-L188 HydrophobicContact CG-CD2 3.88Å; L184-L188 WeakPolarHBondContact O-CB 3.33Å; L184-L188 VanDerWaalsContact O-CG 3.27Å; L184-L188 WeakPolarHBondContact O-CG 3.42Å; L184-L188 PolarHBondContact O-N 2.89Å; L185-L188 PolarHBondContact O-N 3.04Å; L188-L191 PolarHBondContact O-N 3Å; L188-V192 WeakPolarHBondContact O-CG2 3.28Å; L188-V192 PolarHBondContact O-N 3.34Å |
| 189 | Y | 86.3 | Confident | 88.7 | Confident | 50 Ų | 50 | 68.4 Ų | 68.4 | 20% | 0.196 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -57.4 | -49.4 | 174.6 | 171.3 | -82.6 | 0 | 0 | 0 | 111.9 | L185 P186 L187 L191 V192 R193 V228 L232 | L185-Y189 VanDerWaalsContact O-CB 3.32Å; L185-Y189 WeakPolarHBondContact O-CB 3.25Å; L185-Y189 PolarHBondContact O-N 3.31Å; P186-Y189 WeakPolarHBondContact O-CB 3.47Å; P186-Y189 PolarHBondContact O-N 2.94Å; L187-Y189 VanDerWaalsContact C-N 3.32Å; L187-Y189 PolarHBondContact O-N 3.09Å; Y189-L191 VanDerWaalsContact C-N 3.33Å; Y189-L191 PolarHBondContact O-N 3.33Å; Y189-V192 PolarHBondContact O-N 3.37Å; Y189-R193 HydrophobicContact CE1-CB 4.48Å; Y189-R193 WeakPolarHBondContact O-CB 3.47Å; Y189-R193 PolarHBondContact O-N 3.27Å; Y189-R193 PolarHBondContact OH-NH1 3.31Å; Y189-R193 VanDerWaalsContact OH-NH1 3.17Å; Y189-V228 HydrophobicContact CD2-CG1 3.46Å; Y189-V228 VanDerWaalsContact CD2-CG1 3.46Å; Y189-V228 VanDerWaalsContact CD2-O 3.3Å; Y189-V228 WeakPolarHBondContact CD2-O 3.31Å; Y189-V228 HydrophobicContact CE2-CB 4.49Å; Y189-V228 HydrophobicContact CE2-CG1 3.15Å; Y189-V228 WeakPolarHBondContact CE2-O 3.45Å; Y189-L232 HydrophobicContact CE2-CD1 4.46Å |
| 190 | L | 87.8 | Confident | 88 | Confident | 108 Ų | 108 | 70.6 Ų | 70.6 | 57% | 0.565 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -64.1 | -39.7 | -179.5 | -71 | 175.7 | 0 | 0 | 0 | 111.3 | P186 L187 R193 K194 | P186-L190 WeakPolarHBondContact O-CB 3.22Å; P186-L190 VanDerWaalsContact O-CG 3.29Å; P186-L190 WeakPolarHBondContact O-CG 3.38Å; P186-L190 PolarHBondContact O-N 3.29Å; L187-L190 PolarHBondContact O-N 3.12Å; L190-R193 PolarHBondContact O-N 3.47Å; L190-K194 WeakPolarHBondContact O-CB 3.37Å; L190-K194 PolarHBondContact O-N 3.02Å |
| 191 | L | 89.2 | Confident | 87.4 | Confident | 67 Ų | 67 | 73.4 Ų | 73.4 | 35% | 0.351 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.1 | -45.2 | 176 | -69.8 | 175.7 | 0 | 0 | 0 | 112.1 | Y105 L187 L188 Y189 H195 | Y105-L191 HydrophobicContact CD2-CB 3.96Å; Y105-L191 HydrophobicContact CD2-CD1 4.38Å; Y105-L191 HydrophobicContact CE2-CB 3.83Å; Y105-L191 HydrophobicContact CE2-CD1 3.91Å; Y105-L191 HydrophobicContact CE2-CG 4.47Å; L187-L191 HydrophobicContact CD2-CD1 3.75Å; L187-L191 HydrophobicContact CG-CD1 4.39Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.1Å; L187-L191 PolarHBondContact O-N 3.37Å; L188-L191 PolarHBondContact O-N 3Å; Y189-L191 VanDerWaalsContact C-N 3.33Å; Y189-L191 PolarHBondContact O-N 3.33Å; L191-H195 WeakPolarHBondContact O-CB 3.45Å; L191-H195 PolarHBondContact O-N 2.92Å |
| 192 | V | 84.8 | Confident | 86.9 | Confident | 7 Ų | 7 | 76.1 Ų | 76.1 | 4% | 0.042 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -61.5 | -48.8 | 175.2 | 169.3 | 0 | 0 | 0 | 0 | 110.4 | Y105 I108 V109 L188 Y189 K194 H195 I196 | Y105-V192 HydrophobicContact CD2-CG2 4.22Å; I108-V192 HydrophobicContact CD1-CG1 3.74Å; I108-V192 HydrophobicContact CG2-CG1 4.33Å; V109-V192 HydrophobicContact CG2-CG2 4.21Å; L188-V192 WeakPolarHBondContact O-CG2 3.28Å; L188-V192 PolarHBondContact O-N 3.34Å; Y189-V192 PolarHBondContact O-N 3.37Å; V192-K194 PolarHBondContact O-N 2.97Å; V192-H195 PolarHBondContact O-N 2.98Å; V192-I196 HydrophobicContact CG1-CD1 3.67Å; V192-I196 HydrophobicContact CG1-CG1 4.38Å; V192-I196 WeakPolarHBondContact O-CG1 3.32Å; V192-I196 PolarHBondContact O-N 3.4Å |
| 193 | R | 83.6 | Confident | 86.1 | Confident | 132 Ų | 132 | 79.6 Ų | 79.6 | 50% | 0.498 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -62.7 | -42.8 | -179.4 | -171.8 | 171.5 | -179.8 | -179.3 | -6.7 | 112 | Y189 L190 H195 I196 N197 | Y189-R193 HydrophobicContact CE1-CB 4.48Å; Y189-R193 WeakPolarHBondContact O-CB 3.47Å; Y189-R193 PolarHBondContact O-N 3.27Å; Y189-R193 PolarHBondContact OH-NH1 3.31Å; Y189-R193 VanDerWaalsContact OH-NH1 3.17Å; L190-R193 PolarHBondContact O-N 3.47Å; R193-H195 VanDerWaalsContact C-N 3.32Å; R193-H195 PolarHBondContact O-N 3.33Å; R193-I196 PolarHBondContact O-N 2.84Å; R193-N197 WeakPolarHBondContact O-CB 3.39Å; R193-N197 PolarHBondContact O-N 3.35Å; R193-N197 PolarHBondContact O-OD1 3.47Å |
| 194 | K | 86.5 | Confident | 85.2 | Confident | 114 Ų | 114 | 76.6 Ų | 76.6 | 50% | 0.496 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -59.8 | -42.6 | 175.2 | -177.5 | 175.4 | 179.8 | 175.1 | 0 | 111.5 | L190 V192 R198 | L190-K194 WeakPolarHBondContact O-CB 3.37Å; L190-K194 PolarHBondContact O-N 3.02Å; V192-K194 PolarHBondContact O-N 2.97Å; K194-R198 WeakPolarHBondContact O-CB 3.43Å; K194-R198 WeakPolarHBondContact O-CG 3.36Å; K194-R198 PolarHBondContact O-N 3.42Å |
| 195 | H | 85.7 | Confident | 84.2 | Confident | 72 Ų | 72 | 80.8 Ų | 80.8 | 33% | 0.333 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -66.2 | -46.4 | 177.2 | -172.3 | 81.4 | 0 | 0 | 0 | 112 | I108 V109 L191 V192 R193 N197 R198 A199 | I108-H195 PolarHBondContact O-NE2 3.4Å; V109-H195 HydrophobicContact CB-CB 4.42Å; V109-H195 HydrophobicContact CG1-CB 4.2Å; V109-H195 HydrophobicContact CG2-CB 3.71Å; L191-H195 WeakPolarHBondContact O-CB 3.45Å; L191-H195 PolarHBondContact O-N 2.92Å; V192-H195 PolarHBondContact O-N 2.98Å; R193-H195 VanDerWaalsContact C-N 3.32Å; R193-H195 PolarHBondContact O-N 3.33Å; H195-N197 VanDerWaalsContact C-N 3.34Å; H195-N197 PolarHBondContact O-N 3.44Å; H195-R198 PolarHBondContact O-N 2.83Å; H195-A199 WeakPolarHBondContact O-CB 3.06Å; H195-A199 PolarHBondContact O-N 3.41Å |
| 196 | I | 82.8 | Confident | 82.7 | Confident | 71 Ų | 71 | 87.2 Ų | 87.2 | 36% | 0.364 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -59.8 | -45 | 177.1 | -68.5 | 170.2 | 0 | 0 | 0 | 110.8 | I108 V192 R193 A199 H200 | I108-I196 HydrophobicContact CG2-CD1 4.42Å; I108-I196 HydrophobicContact CG2-CG1 4.06Å; V192-I196 HydrophobicContact CG1-CD1 3.67Å; V192-I196 HydrophobicContact CG1-CG1 4.38Å; V192-I196 WeakPolarHBondContact O-CG1 3.32Å; V192-I196 PolarHBondContact O-N 3.4Å; R193-I196 PolarHBondContact O-N 2.84Å; I196-A199 PolarHBondContact O-N 3.47Å; I196-H200 WeakPolarHBondContact O-CB 3.2Å; I196-H200 PolarHBondContact O-N 3.24Å |
| 197 | N | 83.3 | Confident | 81.3 | Confident | 86 Ų | 86 | 93.4 Ų | 93.4 | 46% | 0.46 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63.5 | -44.2 | 179.2 | -71.9 | -4 | 0 | 0 | 0 | 111.5 | R193 H195 A199 H200 M201 | R193-N197 WeakPolarHBondContact O-CB 3.39Å; R193-N197 PolarHBondContact O-N 3.35Å; R193-N197 PolarHBondContact O-OD1 3.47Å; H195-N197 VanDerWaalsContact C-N 3.34Å; H195-N197 PolarHBondContact O-N 3.44Å; N197-A199 PolarHBondContact O-N 2.89Å; N197-H200 PolarHBondContact O-N 3.38Å; N197-M201 WeakPolarHBondContact O-CG 3.41Å; N197-M201 PolarHBondContact O-N 3.06Å |
| 198 | R | 85.1 | Confident | 79.6 | Confident | 161 Ų | 161 | 94.2 Ų | 94.2 | 61% | 0.608 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -60.6 | -45.1 | 175.2 | -76.7 | 178.4 | 179.2 | -169.5 | -6 | 112.1 | K194 H195 H200 M201 A202 | K194-R198 WeakPolarHBondContact O-CB 3.43Å; K194-R198 WeakPolarHBondContact O-CG 3.36Å; K194-R198 PolarHBondContact O-N 3.42Å; H195-R198 PolarHBondContact O-N 2.83Å; R198-H200 VanDerWaalsContact C-N 3.28Å; R198-H200 PolarHBondContact O-N 3.49Å; R198-M201 PolarHBondContact O-N 3.43Å; R198-A202 PolarHBondContact O-N 2.89Å |
| 199 | A | 82.4 | Confident | 78 | Confident | 44 Ų | 44 | 99.3 Ų | 99.3 | 36% | 0.364 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.7 | -37.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | H195 I196 N197 L203 | H195-A199 WeakPolarHBondContact O-CB 3.06Å; H195-A199 PolarHBondContact O-N 3.41Å; I196-A199 PolarHBondContact O-N 3.47Å; N197-A199 PolarHBondContact O-N 2.89Å; A199-L203 WeakPolarHBondContact O-CB 2.97Å; A199-L203 VanDerWaalsContact O-CG 3.29Å; A199-L203 WeakPolarHBondContact O-CG 3.29Å; A199-L203 PolarHBondContact O-N 2.86Å |
| 200 | H | 79.6 | Confident | 76.5 | Confident | 110 Ų | 110 | 101 Ų | 101 | 51% | 0.509 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.2 | -42.8 | 176.8 | -160.8 | 68.8 | 0 | 0 | 0 | 112.5 | I196 N197 R198 L203 S204 | I196-H200 WeakPolarHBondContact O-CB 3.2Å; I196-H200 PolarHBondContact O-N 3.24Å; N197-H200 PolarHBondContact O-N 3.38Å; R198-H200 VanDerWaalsContact C-N 3.28Å; R198-H200 PolarHBondContact O-N 3.49Å; H200-L203 PolarHBondContact O-N 3.49Å; H200-S204 WeakPolarHBondContact O-CB 3.26Å; H200-S204 PolarHBondContact O-N 3.4Å; H200-S204 PolarHBondContact O-OG 3.43Å |
| 201 | M | 82.7 | Confident | 74.7 | Confident | 129 Ų | 129 | 100.8 Ų | 100.8 | 64% | 0.635 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.9 | -47.8 | 176.5 | -69.6 | -60.7 | -64.2 | 0 | 0 | 111.5 | N197 R198 L203 S204 E205 | N197-M201 WeakPolarHBondContact O-CG 3.41Å; N197-M201 PolarHBondContact O-N 3.06Å; R198-M201 PolarHBondContact O-N 3.43Å; M201-L203 VanDerWaalsContact C-N 3.29Å; M201-L203 PolarHBondContact O-N 3.17Å; M201-S204 WeakPolarHBondContact CA-OG 3.48Å; M201-S204 PolarHBondContact O-N 3.04Å; M201-S204 VanDerWaalsContact O-N 3.15Å; M201-S204 PolarHBondContact O-OG 2.85Å; M201-E205 PolarHBondContact O-N 3.16Å; M201-E205 VanDerWaalsContact O-N 3.17Å |
| 202 | A | 82.1 | Confident | 73 | Confident | 59 Ų | 59 | 104.3 Ų | 104.3 | 49% | 0.488 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -60.4 | -38.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | R198 | R198-A202 PolarHBondContact O-N 2.89Å |
| 203 | L | 75.6 | Confident | 71 | Confident | 119 Ų | 119 | 112.5 Ų | 112.5 | 62% | 0.623 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -73 | -32.1 | 175.7 | -75.9 | 169.9 | 0 | 0 | 0 | 113.2 | A199 H200 M201 E205 Y206 R207 | A199-L203 WeakPolarHBondContact O-CB 2.97Å; A199-L203 VanDerWaalsContact O-CG 3.29Å; A199-L203 WeakPolarHBondContact O-CG 3.29Å; A199-L203 PolarHBondContact O-N 2.86Å; H200-L203 PolarHBondContact O-N 3.49Å; M201-L203 VanDerWaalsContact C-N 3.29Å; M201-L203 PolarHBondContact O-N 3.17Å; L203-E205 VanDerWaalsContact C-N 3.31Å; L203-Y206 PolarHBondContact O-N 2.86Å; L203-R207 PolarHBondContact O-N 3.18Å |
| 204 | S | 73.8 | Confident | 69.1 | Low | 52 Ų | 52 | 112.2 Ų | 112.2 | 36% | 0.364 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -68.8 | -31.5 | 177.7 | 58.2 | 0 | 0 | 0 | 0 | 112.6 | H200 M201 Y206 R207 | H200-S204 WeakPolarHBondContact O-CB 3.26Å; H200-S204 PolarHBondContact O-N 3.4Å; H200-S204 PolarHBondContact O-OG 3.43Å; M201-S204 WeakPolarHBondContact CA-OG 3.48Å; M201-S204 PolarHBondContact O-N 3.04Å; M201-S204 VanDerWaalsContact O-N 3.15Å; M201-S204 PolarHBondContact O-OG 2.85Å; S204-Y206 VanDerWaalsContact C-N 3.32Å; S204-R207 WeakPolarHBondContact O-CB 3.41Å; S204-R207 PolarHBondContact O-N 2.87Å |
| 205 | E | 72.8 | Confident | 67.1 | Low | 164 Ų | 164 | 116.9 Ų | 116.9 | 77% | 0.766 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -67.6 | -34 | 173.8 | -169.9 | 174.2 | 178.6 | 0 | 0 | 111.7 | M201 L203 P208 | M201-E205 PolarHBondContact O-N 3.16Å; M201-E205 VanDerWaalsContact O-N 3.17Å; L203-E205 VanDerWaalsContact C-N 3.31Å; E205-P208 WeakPolarHBondContact O-CD 3.41Å |
| 206 | Y | 61.1 | Low | 65 | Low | 135 Ų | 135 | 119.9 Ų | 119.9 | 53% | 0.529 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -91.2 | -8.3 | 179.8 | -139.6 | -83.9 | 0 | 0 | 0 | 114.1 | L203 S204 I209 L210 | L203-Y206 PolarHBondContact O-N 2.86Å; S204-Y206 VanDerWaalsContact C-N 3.32Å; Y206-I209 HydrophobicContact CD1-CB 4.34Å; Y206-I209 HydrophobicContact CE1-CB 4.3Å; Y206-I209 HydrophobicContact CE1-CG2 4.41Å; Y206-I209 PolarHBondContact O-N 3.24Å; Y206-I209 VanDerWaalsContact O-N 3.13Å; Y206-L210 HydrophobicContact CD1-CB 4.34Å; Y206-L210 HydrophobicContact CD1-CD1 3.57Å; Y206-L210 HydrophobicContact CD1-CG 4.25Å; Y206-L210 HydrophobicContact CE1-CD1 3.74Å; Y206-L210 HydrophobicContact CE1-CG 4.33Å |
| 207 | R | 60.6 | Low | 63.1 | Low | 176 Ų | 176 | 121.4 Ų | 121.4 | 66% | 0.664 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.3 | -33.4 | -177.2 | -175 | 178.6 | -88.7 | -171.9 | -5.6 | 115.2 | L203 S204 I209 | L203-R207 PolarHBondContact O-N 3.18Å; S204-R207 WeakPolarHBondContact O-CB 3.41Å; S204-R207 PolarHBondContact O-N 2.87Å; R207-I209 PolarHBondContact O-N 2.85Å |
| 208 | P | 55.8 | Low | 61.3 | Low | 107 Ų | 107 | 126.1 Ų | 126.1 | 70% | 0.695 | 62% | 0.619 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | -7.3 | 178.1 | 24.7 | -29.1 | 0 | 0 | 0 | 114.2 | E205 | E205-P208 WeakPolarHBondContact O-CD 3.41Š|
| 209 | I | 56.4 | Low | 59.4 | Low | 123 Ų | 123 | 129.2 Ų | 129.2 | 63% | 0.631 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.5 | -18 | -174.1 | -50 | 178.6 | 0 | 0 | 0 | 112.6 | Y206 R207 | Y206-I209 HydrophobicContact CD1-CB 4.34Å; Y206-I209 HydrophobicContact CE1-CB 4.3Å; Y206-I209 HydrophobicContact CE1-CG2 4.41Å; Y206-I209 PolarHBondContact O-N 3.24Å; Y206-I209 VanDerWaalsContact O-N 3.13Å; R207-I209 PolarHBondContact O-N 2.85Å |
| 210 | L | 55.9 | Low | 57.6 | Low | 86 Ų | 86 | 128.8 Ų | 128.8 | 45% | 0.45 | 62% | 0.624 | S | S | . | * | trans | -117.2 | 32.7 | -164.4 | -118.5 | 167.6 | 0 | 0 | 0 | 113.6 | Y206 E212 H214 | Y206-L210 HydrophobicContact CD1-CB 4.34Å; Y206-L210 HydrophobicContact CD1-CD1 3.57Å; Y206-L210 HydrophobicContact CD1-CG 4.25Å; Y206-L210 HydrophobicContact CE1-CD1 3.74Å; Y206-L210 HydrophobicContact CE1-CG 4.33Å; L210-E212 PolarHBondContact O-N 2.98Å; L210-E212 VanDerWaalsContact O-N 3.14Å; L210-H214 HydrophobicContact CD2-CB 3.78Å | ||
| 211 | S | 50 | Low | 56.4 | Low | 102 Ų | 102 | 126.7 Ų | 126.7 | 71% | 0.713 | 62% | 0.622 | S | S | * | * | S | Bend | trans | -80.6 | 84.9 | 175.3 | 59.6 | 0 | 0 | 0 | 0 | 111.2 | ||
| 212 | E | 51.6 | Low | 54.9 | Low | 141 Ų | 141 | 125.2 Ų | 125.2 | 66% | 0.659 | 62% | 0.62 | S | S | * | * | S | Bend | trans | 154.1 | -37.3 | 137.4 | -86.8 | -68.1 | 116.6 | 0 | 0 | 113.1 | L210 | L210-E212 PolarHBondContact O-N 2.98Å; L210-E212 VanDerWaalsContact O-N 3.14Å |
| 213 | E | 43.7 | Very low | 53.3 | Low | 180 Ų | 180 | 123 Ų | 123 | 84% | 0.841 | 60% | 0.602 | S | S | * | * | S | Bend | trans | -87.4 | -29.4 | -166.1 | -87 | -166.6 | 146.1 | 0 | 0 | 116.8 | ||
| 214 | H | 43.5 | Very low | 52.3 | Low | 126 Ų | 126 | 118.8 Ų | 118.8 | 58% | 0.583 | 58% | 0.58 | S | S | * | * | trans | -111 | 67.3 | -177.7 | -78.3 | 75.3 | 0 | 0 | 0 | 112 | L210 L216 | L210-H214 HydrophobicContact CD2-CB 3.78Å; H214-L216 HydrophobicContact CB-CD1 4.49Å; H214-L216 PolarHBondContact O-N 2.9Å | ||
| 215 | R | 44.8 | Very low | 51.8 | Low | 211 Ų | 211 | 121.6 Ų | 121.6 | 80% | 0.796 | 59% | 0.586 | S | S | * | * | trans | -67.7 | 59.6 | 151.5 | -67.8 | -176.3 | 179.5 | 179.4 | 3.8 | 109.3 | ||||
| 216 | L | 42.1 | Very low | 51.6 | Low | 136 Ų | 136 | 115.6 Ų | 115.6 | 71% | 0.712 | 56% | 0.557 | S | S | * | * | trans | -49.9 | 118 | 166.3 | -99.3 | 151.4 | 0 | 0 | 0 | 106 | H214 R218 | H214-L216 HydrophobicContact CB-CD1 4.49Å; H214-L216 PolarHBondContact O-N 2.9Å; L216-R218 PolarHBondContact O-N 3.43Å | ||
| 217 | P | 42 | Very low | 51.8 | Low | 103 Ų | 103 | 109.6 Ų | 109.6 | 67% | 0.669 | 53% | 0.534 | S | S | * | . | trans | -56 | 120.8 | -167.8 | 18.8 | -29.8 | 0 | 0 | 0 | 107.3 | R219 | P217-R219 WeakPolarHBondContact O-CA 3.31Å; P217-R219 PolarHBondContact O-N 3.26Å | ||
| 218 | R | 45.4 | Very low | 52.2 | Low | 184 Ų | 184 | 103 Ų | 103 | 69% | 0.694 | 51% | 0.513 | S | S | * | . | trans | -45.8 | 91.3 | 171.2 | -165.7 | -177.6 | -147 | -171.7 | 8.3 | 107.3 | L216 C220 | L216-R218 PolarHBondContact O-N 3.43Å; R218-C220 CarbonylContact O-C 3.31Å; R218-C220 PolarHBondContact O-N 3.41Å | ||
| 219 | R | 45.2 | Very low | 53.2 | Low | 226 Ų | 226 | 101.1 Ų | 101.1 | 85% | 0.853 | 50% | 0.497 | S | S | * | . | S | Bend | trans | -65.6 | -3.3 | -167.1 | -103.5 | -177.4 | 179.8 | -169.6 | 1.5 | 113.8 | P217 | P217-R219 WeakPolarHBondContact O-CA 3.31Å; P217-R219 PolarHBondContact O-N 3.26Å |
| 220 | C | 45.7 | Very low | 54.2 | Low | 35 Ų | 35 | 95.3 Ų | 95.3 | 24% | 0.236 | 47% | 0.467 | C | S | . | . | S | Bend | trans | -108.9 | 115.2 | 162.5 | -95.2 | 0 | 0 | 0 | 0 | 110.2 | R218 D224 | R218-C220 CarbonylContact O-C 3.31Å; R218-C220 PolarHBondContact O-N 3.41Å; C220-D224 VanDerWaalsContact CA-OD2 3.29Å; C220-D224 WeakPolarHBondContact CA-OD2 3.42Å; C220-D224 HydrophobicContact CB-CB 3.92Å; C220-D224 VanDerWaalsContact SG-CB 3.57Å |
| 221 | S | 53.6 | Low | 55.2 | Low | 66 Ų | 66 | 91.7 Ų | 91.7 | 46% | 0.462 | 45% | 0.449 | S | S | . | . | trans | -57.6 | 157.6 | 168.6 | 175.9 | 0 | 0 | 0 | 0 | 110.1 | A223 D224 K225 | S221-A223 PolarHBondContact O-N 2.93Å; S221-A223 PolarHBondContact OG-N 3.01Å; S221-D224 PolarHBondContact N-OD2 2.83Å; S221-D224 WeakPolarHBondContact O-CB 3.29Å; S221-D224 PolarHBondContact O-N 3.37Å; S221-K225 PolarHBondContact O-N 3.44Å | ||
| 222 | V | 50.8 | Low | 56.7 | Low | 99 Ų | 99 | 90.7 Ų | 90.7 | 60% | 0.6 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -53.6 | -26.9 | 168.1 | -179.7 | 0 | 0 | 0 | 0 | 111 | ||
| 223 | A | 48.2 | Very low | 58.5 | Low | 13 Ų | 13 | 85.4 Ų | 85.4 | 11% | 0.107 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -65 | -35 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | S221 K226 | S221-A223 PolarHBondContact O-N 2.93Å; S221-A223 PolarHBondContact OG-N 3.01Å; A223-K226 PolarHBondContact O-N 3.25Å |
| 224 | D | 56 | Low | 60.7 | Low | 29 Ų | 29 | 76.9 Ų | 76.9 | 16% | 0.155 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -74.7 | -29.8 | -177.7 | -58.4 | -34.5 | 0 | 0 | 0 | 112 | C220 S221 K226 L227 | C220-D224 VanDerWaalsContact CA-OD2 3.29Å; C220-D224 WeakPolarHBondContact CA-OD2 3.42Å; C220-D224 HydrophobicContact CB-CB 3.92Å; C220-D224 VanDerWaalsContact SG-CB 3.57Å; S221-D224 PolarHBondContact N-OD2 2.83Å; S221-D224 WeakPolarHBondContact O-CB 3.29Å; S221-D224 PolarHBondContact O-N 3.37Å; D224-K226 PolarHBondContact O-N 2.87Å; D224-L227 PolarHBondContact O-N 2.9Å |
| 225 | K | 61.5 | Low | 62.9 | Low | 111 Ų | 111 | 73 Ų | 73 | 48% | 0.483 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -67.5 | -23.5 | 172.4 | -69.6 | -172.6 | 178.5 | -177.9 | 0 | 113.3 | S221 V228 | S221-K225 PolarHBondContact O-N 3.44Å; K225-V228 WeakPolarHBondContact O-CB 3.17Å |
| 226 | K | 68.9 | Low | 65.1 | Low | 38 Ų | 38 | 67 Ų | 67 | 17% | 0.165 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -80.6 | -28.6 | 177.2 | -67.2 | 179.2 | 173.8 | -168 | 0 | 112.6 | A223 D224 V228 L229 M278 F279 C282 T283 | A223-K226 PolarHBondContact O-N 3.25Å; D224-K226 PolarHBondContact O-N 2.87Å; K226-V228 PolarHBondContact O-N 3.38Å; K226-L229 WeakPolarHBondContact O-CB 3.46Å; K226-L229 PolarHBondContact O-N 2.84Å; K226-M278 HydrophobicContact CB-CE 4Å; K226-M278 HydrophobicContact CD-CE 4.42Å; K226-M278 HydrophobicContact CG-CE 4.21Å; K226-M278 PolarHBondContact NZ-O 3.27Å; K226-F279 HydrophobicContact CB-CE1 4.09Å; K226-F279 HydrophobicContact CB-CZ 4.47Å; K226-C282 PolarHBondContact NZ-O 3.35Å; K226-T283 PolarHBondContact NZ-OG1 2.9Å |
| 227 | L | 66.8 | Low | 67.5 | Low | 9 Ų | 9 | 61.7 Ų | 61.7 | 5% | 0.047 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -62.2 | -24.1 | 174.3 | -63.7 | 162.6 | 0 | 0 | 0 | 112 | A46 I100 L104 D224 L229 I230 P231 F279 | A46-L227 HydrophobicContact CB-CD1 3.9Å; I100-L227 HydrophobicContact CG2-CD2 4.09Å; L104-L227 HydrophobicContact CD1-CB 3.3Å; L104-L227 HydrophobicContact CD1-CD1 3.92Å; L104-L227 HydrophobicContact CD1-CG 4.14Å; L104-L227 HydrophobicContact CD2-CB 4.31Å; L104-L227 HydrophobicContact CD2-CD1 3.58Å; L104-L227 HydrophobicContact CG-CB 4.41Å; L104-L227 HydrophobicContact CG-CD1 4.25Å; D224-L227 PolarHBondContact O-N 2.9Å; L227-L229 PolarHBondContact O-N 2.86Å; L227-I230 HydrophobicContact CB-CD1 4.34Å; L227-I230 HydrophobicContact CD2-CD1 3.53Å; L227-I230 WeakPolarHBondContact O-CB 3.01Å; L227-I230 PolarHBondContact O-N 3.34Å; L227-P231 WeakPolarHBondContact O-CD 3.4Å; L227-F279 HydrophobicContact CB-CZ 4.44Å; L227-F279 HydrophobicContact CD2-CD1 4.49Å; L227-F279 HydrophobicContact CD2-CE1 3.49Å; L227-F279 VanDerWaalsContact CD2-CE1 3.49Å; L227-F279 HydrophobicContact CD2-CE2 4.29Å; L227-F279 HydrophobicContact CD2-CZ 3.4Å; L227-F279 VanDerWaalsContact CD2-CZ 3.4Å; L227-F279 HydrophobicContact CG-CE1 3.76Å; L227-F279 HydrophobicContact CG-CZ 3.93Å |
| 228 | V | 68.6 | Low | 70 | Confident | 37 Ų | 37 | 56.9 Ų | 56.9 | 22% | 0.224 | 29% | 0.285 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -63.9 | -20.6 | 172.3 | 173.8 | 0 | 0 | 0 | 0 | 112.4 | Y189 K225 K226 | Y189-V228 HydrophobicContact CD2-CG1 3.46Å; Y189-V228 VanDerWaalsContact CD2-CG1 3.46Å; Y189-V228 VanDerWaalsContact CD2-O 3.3Å; Y189-V228 WeakPolarHBondContact CD2-O 3.31Å; Y189-V228 HydrophobicContact CE2-CB 4.49Å; Y189-V228 HydrophobicContact CE2-CG1 3.15Å; Y189-V228 WeakPolarHBondContact CE2-O 3.45Å; K225-V228 WeakPolarHBondContact O-CB 3.17Å; K226-V228 PolarHBondContact O-N 3.38Å |
| 229 | L | 77 | Confident | 72.3 | Confident | 68 Ų | 68 | 50.5 Ų | 50.5 | 36% | 0.356 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.8 | -17.8 | 176.3 | -167.3 | 62.9 | 0 | 0 | 0 | 113.4 | K226 L227 L232 I233 M278 | K226-L229 WeakPolarHBondContact O-CB 3.46Å; K226-L229 PolarHBondContact O-N 2.84Å; L227-L229 PolarHBondContact O-N 2.86Å; L229-L232 HydrophobicContact CD1-CB 4.09Å; L229-L232 HydrophobicContact CD1-CD1 3.74Å; L229-L232 HydrophobicContact CD1-CG 4.49Å; L229-L232 PolarHBondContact O-N 2.92Å; L229-L232 VanDerWaalsContact O-N 3.09Å; L229-I233 HydrophobicContact CD2-CD1 4.16Å; L229-I233 HydrophobicContact CG-CD1 3.99Å; L229-I233 HydrophobicContact CG-CG1 4.19Å; L229-I233 PolarHBondContact O-N 3.25Å; L229-I233 VanDerWaalsContact O-N 3.1Å; L229-M278 HydrophobicContact CB-CE 4.17Å; L229-M278 HydrophobicContact CD2-CE 3.49Å; L229-M278 VanDerWaalsContact CD2-CE 3.49Å; L229-M278 HydrophobicContact CD2-SD 3.69Å; L229-M278 HydrophobicContact CG-CE 4.37Å |
| 230 | I | 77.5 | Confident | 74.6 | Confident | 2 Ų | 2 | 44 Ų | 44 | 1% | 0.01 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -54.1 | -49.2 | 179 | -67.4 | 173.5 | 0 | 0 | 0 | 111.6 | T97 I100 L227 L232 I233 F234 F279 | T97-I230 HydrophobicContact CG2-CG2 3.91Å; I100-I230 HydrophobicContact CG2-CD1 4.23Å; L227-I230 HydrophobicContact CB-CD1 4.34Å; L227-I230 HydrophobicContact CD2-CD1 3.53Å; L227-I230 WeakPolarHBondContact O-CB 3.01Å; L227-I230 PolarHBondContact O-N 3.34Å; I230-L232 VanDerWaalsContact C-N 3.26Å; I230-L232 PolarHBondContact O-N 3.34Å; I230-I233 PolarHBondContact O-N 3.33Å; I230-F234 WeakPolarHBondContact O-CB 3.31Å; I230-F234 PolarHBondContact O-N 3.03Å; I230-F279 HydrophobicContact CD1-CE2 3.51Å; I230-F279 HydrophobicContact CD1-CZ 3.53Å; I230-F279 HydrophobicContact CG1-CE2 3.65Å; I230-F279 HydrophobicContact CG1-CZ 3.75Å |
| 231 | P | 76.6 | Confident | 76.8 | Confident | 10 Ų | 10 | 42.6 Ų | 42.6 | 7% | 0.065 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -49 | -43 | 174.6 | -37.5 | 41.9 | 0 | 0 | 0 | 115.3 | L185 L227 I235 | L185-P231 HydrophobicContact CB-CB 3.87Å; L185-P231 HydrophobicContact CB-CG 4.22Å; L185-P231 HydrophobicContact CD2-CG 4.47Å; L227-P231 WeakPolarHBondContact O-CD 3.4Å; P231-I235 WeakPolarHBondContact O-CD1 3.2Å; P231-I235 VanDerWaalsContact O-CG1 3.27Å; P231-I235 WeakPolarHBondContact O-CG1 3.48Å; P231-I235 PolarHBondContact O-N 3.48Å |
| 232 | L | 81.8 | Confident | 78.7 | Confident | 80 Ų | 80 | 40.4 Ų | 40.4 | 42% | 0.419 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -72.1 | -45.6 | -176.4 | -67.8 | 171.4 | 0 | 0 | 0 | 110.5 | Y189 L229 I230 F234 I235 C236 | Y189-L232 HydrophobicContact CE2-CD1 4.46Å; L229-L232 HydrophobicContact CD1-CB 4.09Å; L229-L232 HydrophobicContact CD1-CD1 3.74Å; L229-L232 HydrophobicContact CD1-CG 4.49Å; L229-L232 PolarHBondContact O-N 2.92Å; L229-L232 VanDerWaalsContact O-N 3.09Å; I230-L232 VanDerWaalsContact C-N 3.26Å; I230-L232 PolarHBondContact O-N 3.34Å; L232-F234 VanDerWaalsContact C-N 3.29Å; L232-F234 PolarHBondContact O-N 2.87Å; L232-I235 PolarHBondContact O-N 3.26Å; L232-C236 WeakPolarHBondContact O-CB 3.25Å; L232-C236 PolarHBondContact O-N 3.45Å; L232-C236 PolarHBondContact O-SG 2.89Å |
| 233 | I | 88.3 | Confident | 80.7 | Confident | 31 Ų | 31 | 38.2 Ų | 38.2 | 16% | 0.159 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -58.1 | -46 | 174.9 | -69.5 | 169.6 | 0 | 0 | 0 | 110.4 | L229 I230 I235 C236 L237 A274 M278 | L229-I233 HydrophobicContact CD2-CD1 4.16Å; L229-I233 HydrophobicContact CG-CD1 3.99Å; L229-I233 HydrophobicContact CG-CG1 4.19Å; L229-I233 PolarHBondContact O-N 3.25Å; L229-I233 VanDerWaalsContact O-N 3.1Å; I230-I233 PolarHBondContact O-N 3.33Å; I233-I235 PolarHBondContact O-N 2.65Å; I233-C236 PolarHBondContact O-N 3.47Å; I233-L237 HydrophobicContact CG2-CD1 3.83Å; I233-L237 HydrophobicContact CG2-CG 4.41Å; I233-L237 WeakPolarHBondContact O-CB 3.41Å; I233-L237 WeakPolarHBondContact O-CG 3.44Å; I233-L237 PolarHBondContact O-N 3.43Å; I233-A274 HydrophobicContact CG2-CB 3.5Å; I233-M278 HydrophobicContact CD1-CG 3.46Å; I233-M278 VanDerWaalsContact CD1-CG 3.46Å; I233-M278 HydrophobicContact CD1-SD 4.14Å |
| 234 | F | 89.8 | Confident | 82.7 | Confident | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -55.9 | -52.1 | 177 | 178.8 | -93 | 0 | 0 | 0 | 111.4 | F94 T97 A181 Y182 L185 I230 L232 C236 L237 R238 | F94-F234 AromaticContact CD1-CE2 3.44Å; F94-F234 HydrophobicContact CD1-CE2 3.44Å; F94-F234 VanDerWaalsContact CD1-CE2 3.44Å; F94-F234 AromaticContact CD1-CZ 3.33Å; F94-F234 HydrophobicContact CD1-CZ 3.33Å; F94-F234 AromaticContact CE1-CE2 3.69Å; F94-F234 HydrophobicContact CE1-CE2 3.69Å; F94-F234 AromaticContact CE1-CZ 3.51Å; F94-F234 HydrophobicContact CE1-CZ 3.51Å; F94-F234 HydrophobicContact CG-CZ 4.35Å; T97-F234 HydrophobicContact CG2-CB 4.29Å; T97-F234 HydrophobicContact CG2-CD2 4.02Å; T97-F234 HydrophobicContact CG2-CG 4.1Å; A181-F234 HydrophobicContact CB-CE1 3.7Å; A181-F234 HydrophobicContact CB-CZ 4.15Å; Y182-F234 HydrophobicContact CD1-CE1 4.12Å; Y182-F234 HydrophobicContact CE1-CD1 4.37Å; Y182-F234 AromaticContact CE1-CE1 3.91Å; Y182-F234 HydrophobicContact CE1-CE1 3.91Å; L185-F234 HydrophobicContact CD1-CB 4.39Å; L185-F234 HydrophobicContact CD1-CD1 3.5Å; L185-F234 HydrophobicContact CD1-CE1 4.02Å; L185-F234 HydrophobicContact CD1-CG 4.03Å; I230-F234 WeakPolarHBondContact O-CB 3.31Å; I230-F234 PolarHBondContact O-N 3.03Å; L232-F234 VanDerWaalsContact C-N 3.29Å; L232-F234 PolarHBondContact O-N 2.87Å; F234-C236 PolarHBondContact O-N 3.05Å; F234-L237 PolarHBondContact O-N 3.35Å; F234-R238 HydrophobicContact CD1-CG 4.37Å; F234-R238 HydrophobicContact CD2-CG 4Å; F234-R238 HydrophobicContact CE1-CG 4.08Å; F234-R238 HydrophobicContact CE2-CG 3.66Å; F234-R238 HydrophobicContact CG-CG 4.34Å; F234-R238 HydrophobicContact CZ-CG 3.72Å; F234-R238 VanDerWaalsContact O-CB 3.31Å; F234-R238 WeakPolarHBondContact O-CB 3.03Å; F234-R238 VanDerWaalsContact O-CG 3.23Å; F234-R238 WeakPolarHBondContact O-CG 3.23Å; F234-R238 PolarHBondContact O-N 3.43Å |
| 235 | I | 89.6 | Confident | 84.3 | Confident | 44 Ų | 44 | 36.8 Ų | 36.8 | 23% | 0.226 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -61.7 | -46.9 | 179.8 | -67.5 | 164.9 | 0 | 0 | 0 | 111 | Y182 P186 P231 L232 I233 L237 R238 V239 | Y182-I235 HydrophobicContact CD1-CG1 3.89Å; Y182-I235 HydrophobicContact CE1-CG1 4.39Å; P186-I235 HydrophobicContact CG-CD1 3.61Å; P231-I235 WeakPolarHBondContact O-CD1 3.2Å; P231-I235 VanDerWaalsContact O-CG1 3.27Å; P231-I235 WeakPolarHBondContact O-CG1 3.48Å; P231-I235 PolarHBondContact O-N 3.48Å; L232-I235 PolarHBondContact O-N 3.26Å; I233-I235 PolarHBondContact O-N 2.65Å; I235-L237 VanDerWaalsContact C-N 3.29Å; I235-L237 PolarHBondContact O-N 2.96Å; I235-R238 PolarHBondContact O-N 3.39Å; I235-V239 WeakPolarHBondContact O-CB 3.45Å; I235-V239 PolarHBondContact O-N 2.97Å |
| 236 | C | 91.8 | Very high | 85.7 | Confident | 85 Ų | 85 | 34.8 Ų | 34.8 | 57% | 0.574 | 19% | 0.19 | S | C | * | . | H | α-helix | trans | -61.2 | -35.9 | -179.2 | -70.8 | 0 | 0 | 0 | 0 | 113.3 | L232 I233 F234 W240 | L232-C236 WeakPolarHBondContact O-CB 3.25Å; L232-C236 PolarHBondContact O-N 3.45Å; L232-C236 PolarHBondContact O-SG 2.89Å; I233-C236 PolarHBondContact O-N 3.47Å; F234-C236 PolarHBondContact O-N 3.05Å; C236-W240 PolarHBondContact O-NE1 2.98Å |
| 237 | L | 93.6 | Very high | 86.8 | Confident | 26 Ų | 26 | 34.7 Ų | 34.7 | 14% | 0.136 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -76.9 | -45.5 | 176.7 | -70.5 | 176.2 | 0 | 0 | 0 | 111.3 | I233 F234 I235 G267 F270 A274 | I233-L237 HydrophobicContact CG2-CD1 3.83Å; I233-L237 HydrophobicContact CG2-CG 4.41Å; I233-L237 WeakPolarHBondContact O-CB 3.41Å; I233-L237 WeakPolarHBondContact O-CG 3.44Å; I233-L237 PolarHBondContact O-N 3.43Å; F234-L237 PolarHBondContact O-N 3.35Å; I235-L237 VanDerWaalsContact C-N 3.29Å; I235-L237 PolarHBondContact O-N 2.96Å; L237-G267 WeakPolarHBondContact O-CA 3.04Å; L237-F270 HydrophobicContact CD2-CB 4.44Å; L237-F270 HydrophobicContact CD2-CD1 4.22Å; L237-A274 HydrophobicContact CD1-CB 3.82Å |
| 238 | R | 93.6 | Very high | 87.7 | Confident | 1 Ų | 1 | 35.9 Ų | 35.9 | 0% | 0.004 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -78.2 | -24.6 | -170.5 | -64.5 | -43.3 | -176 | 112.5 | 3.4 | 114.7 | N90 F94 E178 Y182 F234 I235 W240 S241 G267 | N90-R238 VanDerWaalsContact OD1-CZ 3.27Å; N90-R238 PolarHBondContact OD1-NH1 3.16Å; N90-R238 PolarHBondContact OD1-NH2 3.17Å; F94-R238 HydrophobicContact CE1-CG 4.33Å; E178-R238 WeakPolarHBondContact OE1-CB 3.36Å; Y182-R238 HydrophobicContact CE1-CB 3.92Å; Y182-R238 WeakPolarHBondContact OH-CB 2.98Å; Y182-R238 PolarHBondContact OH-O 2.94Å; Y182-R238 VanDerWaalsContact OH-O 3.08Å; F234-R238 HydrophobicContact CD1-CG 4.37Å; F234-R238 HydrophobicContact CD2-CG 4Å; F234-R238 HydrophobicContact CE1-CG 4.08Å; F234-R238 HydrophobicContact CE2-CG 3.66Å; F234-R238 HydrophobicContact CG-CG 4.34Å; F234-R238 HydrophobicContact CZ-CG 3.72Å; F234-R238 VanDerWaalsContact O-CB 3.31Å; F234-R238 WeakPolarHBondContact O-CB 3.03Å; F234-R238 VanDerWaalsContact O-CG 3.23Å; F234-R238 WeakPolarHBondContact O-CG 3.23Å; F234-R238 PolarHBondContact O-N 3.43Å; I235-R238 PolarHBondContact O-N 3.39Å; R238-W240 PolarHBondContact O-N 2.86Å; R238-S241 WeakPolarHBondContact O-CB 3.29Å; R238-S241 PolarHBondContact O-N 3.3Å; R238-G267 WeakPolarHBondContact CD-O 3.34Å |
| 239 | V | 93.7 | Very high | 88.6 | Confident | 51 Ų | 51 | 38.1 Ų | 38.1 | 31% | 0.309 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -53 | -35.4 | -173.9 | 67.6 | 0 | 0 | 0 | 0 | 113.2 | Y182 I235 S241 T242 V243 | Y182-V239 WeakPolarHBondContact OH-CA 3.39Å; Y182-V239 PolarHBondContact OH-N 3.24Å; I235-V239 WeakPolarHBondContact O-CB 3.45Å; I235-V239 PolarHBondContact O-N 2.97Å; V239-S241 VanDerWaalsContact C-N 3.32Å; V239-S241 PolarHBondContact O-N 3.3Å; V239-T242 WeakPolarHBondContact O-CB 3.4Å; V239-T242 PolarHBondContact O-N 2.95Å; V239-T242 VanDerWaalsContact O-N 3.09Å; V239-V243 HydrophobicContact CG2-CG2 4.32Å; V239-V243 WeakPolarHBondContact O-CG2 3.18Å; V239-V243 PolarHBondContact O-N 3.22Å |
| 240 | W | 94.1 | Very high | 89.2 | Confident | 89 Ų | 89 | 39.1 Ų | 39.1 | 34% | 0.337 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -63.8 | -35.8 | -178.9 | -52.4 | 112.2 | 0 | 0 | 0 | 113.2 | C236 R238 T242 V243 R244 L260 L263 H264 | C236-W240 PolarHBondContact O-NE1 2.98Å; R238-W240 PolarHBondContact O-N 2.86Å; W240-T242 VanDerWaalsContact C-N 3.34Å; W240-V243 PolarHBondContact O-N 3.47Å; W240-R244 PolarHBondContact O-N 3.16Å; W240-R244 VanDerWaalsContact O-N 3.11Å; W240-L260 HydrophobicContact CE3-CD2 4.31Å; W240-L263 HydrophobicContact CB-CB 4.03Å; W240-L263 HydrophobicContact CD2-CB 3.71Å; W240-L263 HydrophobicContact CD2-CD1 3.94Å; W240-L263 HydrophobicContact CD2-CG 4.29Å; W240-L263 HydrophobicContact CE3-CB 4.08Å; W240-L263 HydrophobicContact CE3-CD1 3.72Å; W240-L263 HydrophobicContact CE3-CG 4.49Å; W240-L263 HydrophobicContact CG-CB 3.67Å; W240-L263 HydrophobicContact CH2-CD1 3.82Å; W240-L263 HydrophobicContact CZ2-CD1 4.03Å; W240-L263 HydrophobicContact CZ2-CD2 4.4Å; W240-L263 HydrophobicContact CZ3-CD1 3.66Å; W240-H264 HydrophobicContact CB-CB 4.48Å |
| 241 | S | 91.5 | Very high | 89.6 | Confident | 5 Ų | 5 | 46.1 Ų | 46.1 | 4% | 0.035 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -67.2 | -37.1 | 174.4 | -166 | 0 | 0 | 0 | 0 | 111.5 | K175 R238 V239 F245 H264 N268 | K175-S241 PolarHBondContact NZ-O 2.81Å; K175-S241 PolarHBondContact NZ-OG 2.99Å; R238-S241 WeakPolarHBondContact O-CB 3.29Å; R238-S241 PolarHBondContact O-N 3.3Å; V239-S241 VanDerWaalsContact C-N 3.32Å; V239-S241 PolarHBondContact O-N 3.3Å; S241-F245 WeakPolarHBondContact O-CB 3.2Å; S241-F245 PolarHBondContact O-N 2.85Å; S241-F245 VanDerWaalsContact O-N 3.12Å; S241-H264 VanDerWaalsContact CA-CD2 3.42Å; S241-H264 WeakPolarHBondContact CA-CD2 3.4Å; S241-H264 WeakPolarHBondContact CB-CD2 3.48Å; S241-H264 WeakPolarHBondContact CB-NE2 3.42Å; S241-H264 PolarHBondContact OG-CD2 3.21Å; S241-H264 VanDerWaalsContact OG-CD2 3.25Å; S241-H264 PolarHBondContact OG-NE2 3.03Å; S241-N268 WeakPolarHBondContact CB-OD1 3.26Å |
| 242 | T | 92.8 | Very high | 90.2 | Very high | 21 Ų | 21 | 47.3 Ų | 47.3 | 13% | 0.129 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -69.8 | -42.3 | 175.5 | -66.4 | 0 | 0 | 0 | 0 | 111.3 | E178 M179 Y182 V239 W240 R244 F245 V246 | E178-T242 PolarHBondContact OE2-OG1 2.96Å; M179-T242 HydrophobicContact CE-CG2 4.29Å; Y182-T242 HydrophobicContact CE2-CG2 4.42Å; Y182-T242 WeakPolarHBondContact CE2-OG1 3.48Å; Y182-T242 PolarHBondContact OH-OG1 3.27Å; V239-T242 WeakPolarHBondContact O-CB 3.4Å; V239-T242 PolarHBondContact O-N 2.95Å; V239-T242 VanDerWaalsContact O-N 3.09Å; W240-T242 VanDerWaalsContact C-N 3.34Å; T242-R244 PolarHBondContact O-N 3.26Å; T242-F245 WeakPolarHBondContact O-CB 3.31Å; T242-F245 PolarHBondContact O-N 3.46Å; T242-V246 HydrophobicContact CG2-CG2 4.4Å; T242-V246 WeakPolarHBondContact O-CG2 3.35Å; T242-V246 PolarHBondContact O-N 2.96Å |
| 243 | V | 93 | Very high | 90.4 | Very high | 53 Ų | 53 | 49 Ų | 49 | 32% | 0.321 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -57.1 | -50.1 | 177.1 | 170 | 0 | 0 | 0 | 0 | 110.6 | V239 W240 F245 V246 L247 L260 | V239-V243 HydrophobicContact CG2-CG2 4.32Å; V239-V243 WeakPolarHBondContact O-CG2 3.18Å; V239-V243 PolarHBondContact O-N 3.22Å; W240-V243 PolarHBondContact O-N 3.47Å; V243-F245 PolarHBondContact O-N 3.45Å; V243-V246 PolarHBondContact O-N 3.23Å; V243-L247 HydrophobicContact CG1-CD1 3.98Å; V243-L247 HydrophobicContact CG1-CG 4.46Å; V243-L247 VanDerWaalsContact O-CG 3.31Å; V243-L247 WeakPolarHBondContact O-CG 3.35Å; V243-L247 PolarHBondContact O-N 3.24Å; V243-L260 HydrophobicContact CG1-CD2 4.25Å |
| 244 | R | 90.1 | Very high | 90.3 | Very high | 3 Ų | 3 | 49.2 Ų | 49.2 | 1% | 0.011 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.4 | -43.2 | 176.8 | -78.8 | 178.8 | 69.4 | 97.8 | -2.1 | 112.7 | W240 T242 V246 L247 T248 V255 L260 H264 | W240-R244 PolarHBondContact O-N 3.16Å; W240-R244 VanDerWaalsContact O-N 3.11Å; T242-R244 PolarHBondContact O-N 3.26Å; R244-V246 VanDerWaalsContact C-N 3.34Å; R244-V246 PolarHBondContact O-N 2.97Å; R244-L247 PolarHBondContact O-N 2.86Å; R244-L247 VanDerWaalsContact O-N 3.16Å; R244-T248 PolarHBondContact O-N 3.11Å; R244-T248 PolarHBondContact O-OG1 3.41Å; R244-V255 HydrophobicContact CB-CG2 4.35Å; R244-V255 HydrophobicContact CG-CG2 4.46Å; R244-V255 PolarHBondContact NH1-O 3.47Å; R244-V255 PolarHBondContact NH2-O 2.92Å; R244-L260 WeakPolarHBondContact CD-O 3.48Å; R244-L260 HydrophobicContact CG-CB 4.25Å; R244-H264 VanDerWaalsContact CD-ND1 3.29Å; R244-H264 WeakPolarHBondContact CD-ND1 3.19Å; R244-H264 HydrophobicContact CG-CB 4.48Å; R244-H264 PolarHBondContact NE-ND1 2.9Å |
| 245 | F | 89.9 | Confident | 90 | Very high | 9 Ų | 9 | 49.9 Ų | 49.9 | 4% | 0.039 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -56.9 | -46.4 | 176.6 | 173.8 | -107.9 | 0 | 0 | 0 | 112.2 | M170 L171 K175 M179 S241 T242 V243 T248 L249 | M170-F245 HydrophobicContact CB-CE2 3.99Å; M170-F245 HydrophobicContact CE-CD2 3.48Å; M170-F245 VanDerWaalsContact CE-CD2 3.48Å; M170-F245 HydrophobicContact CE-CE2 3.42Å; M170-F245 VanDerWaalsContact CE-CE2 3.42Å; M170-F245 HydrophobicContact SD-CE2 4.04Å; L171-F245 HydrophobicContact CD2-CE1 4.33Å; L171-F245 HydrophobicContact CD2-CZ 4.15Å; K175-F245 HydrophobicContact CB-CE1 4.28Å; K175-F245 HydrophobicContact CB-CZ 4.37Å; K175-F245 HydrophobicContact CD-CB 3.95Å; K175-F245 HydrophobicContact CD-CD1 3.91Å; K175-F245 HydrophobicContact CD-CD2 4.14Å; K175-F245 HydrophobicContact CD-CE1 4.43Å; K175-F245 HydrophobicContact CD-CG 3.73Å; K175-F245 HydrophobicContact CG-CD1 4.15Å; K175-F245 HydrophobicContact CG-CD2 4.01Å; K175-F245 HydrophobicContact CG-CE1 4.22Å; K175-F245 HydrophobicContact CG-CE2 4.08Å; K175-F245 HydrophobicContact CG-CG 4.03Å; K175-F245 HydrophobicContact CG-CZ 4.17Å; M179-F245 HydrophobicContact CE-CD1 4.11Å; M179-F245 HydrophobicContact CE-CE1 4.02Å; S241-F245 WeakPolarHBondContact O-CB 3.2Å; S241-F245 PolarHBondContact O-N 2.85Å; S241-F245 VanDerWaalsContact O-N 3.12Å; T242-F245 WeakPolarHBondContact O-CB 3.31Å; T242-F245 PolarHBondContact O-N 3.46Å; V243-F245 PolarHBondContact O-N 3.45Å; F245-T248 WeakPolarHBondContact O-CB 3.28Å; F245-T248 PolarHBondContact O-N 3.18Å; F245-L249 HydrophobicContact CD1-CD1 4.18Å; F245-L249 HydrophobicContact CE1-CD1 3.59Å; F245-L249 HydrophobicContact CE1-CG 4.38Å; F245-L249 HydrophobicContact CE2-CD1 4.32Å; F245-L249 HydrophobicContact CE2-CD2 4.41Å; F245-L249 HydrophobicContact CE2-CG 4.35Å; F245-L249 HydrophobicContact CZ-CD1 3.68Å; F245-L249 HydrophobicContact CZ-CD2 4.38Å; F245-L249 HydrophobicContact CZ-CG 4.19Å; F245-L249 WeakPolarHBondContact O-CG 3.22Å; F245-L249 PolarHBondContact O-N 3.24Å |
| 246 | V | 91.6 | Very high | 89.7 | Confident | 68 Ų | 68 | 52.4 Ų | 52.4 | 41% | 0.412 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 176.4 | 173.9 | 0 | 0 | 0 | 0 | 111.2 | T242 V243 R244 T248 L249 C250 | T242-V246 HydrophobicContact CG2-CG2 4.4Å; T242-V246 WeakPolarHBondContact O-CG2 3.35Å; T242-V246 PolarHBondContact O-N 2.96Å; V243-V246 PolarHBondContact O-N 3.23Å; R244-V246 VanDerWaalsContact C-N 3.34Å; R244-V246 PolarHBondContact O-N 2.97Å; V246-T248 VanDerWaalsContact C-N 3.32Å; V246-T248 PolarHBondContact O-N 3.42Å; V246-L249 PolarHBondContact O-N 3.45Å; V246-C250 PolarHBondContact O-N 3.05Å; V246-C250 PolarHBondContact O-SG 3.48Å |
| 247 | L | 90.7 | Very high | 89.6 | Confident | 37 Ų | 37 | 51.3 Ų | 51.3 | 19% | 0.194 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -62.1 | -38.5 | 176.2 | -69.5 | 172.5 | 0 | 0 | 0 | 112.3 | V243 R244 C250 N251 S252 A254 V255 L260 | V243-L247 HydrophobicContact CG1-CD1 3.98Å; V243-L247 HydrophobicContact CG1-CG 4.46Å; V243-L247 VanDerWaalsContact O-CG 3.31Å; V243-L247 WeakPolarHBondContact O-CG 3.35Å; V243-L247 PolarHBondContact O-N 3.24Å; R244-L247 PolarHBondContact O-N 2.86Å; R244-L247 VanDerWaalsContact O-N 3.16Å; L247-C250 CarbonylContact O-C 3.59Å; L247-C250 PolarHBondContact O-N 3.37Å; L247-N251 PolarHBondContact O-N 3.37Å; L247-S252 PolarHBondContact O-N 2.94Å; L247-A254 HydrophobicContact CD1-CB 4.33Å; L247-A254 HydrophobicContact CD2-CB 4.44Å; L247-V255 HydrophobicContact CB-CB 4.11Å; L247-V255 HydrophobicContact CB-CG2 4.45Å; L247-L260 HydrophobicContact CD1-CD1 3.69Å |
| 248 | T | 86.4 | Confident | 89.2 | Confident | 34 Ų | 34 | 53.7 Ų | 53.7 | 21% | 0.209 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -61.7 | -48 | 172.9 | -52 | 0 | 0 | 0 | 0 | 110.9 | V152 R244 F245 V246 C250 N251 | V152-T248 HydrophobicContact CG1-CG2 3.59Å; R244-T248 PolarHBondContact O-N 3.11Å; R244-T248 PolarHBondContact O-OG1 3.41Å; F245-T248 WeakPolarHBondContact O-CB 3.28Å; F245-T248 PolarHBondContact O-N 3.18Å; V246-T248 VanDerWaalsContact C-N 3.32Å; V246-T248 PolarHBondContact O-N 3.42Å; T248-C250 PolarHBondContact O-N 3.07Å; T248-N251 PolarHBondContact O-N 3.36Å |
| 249 | L | 87.5 | Confident | 89.1 | Confident | 83 Ų | 83 | 58.2 Ų | 58.2 | 44% | 0.435 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61 | -32.4 | 178 | -67 | -179.6 | 0 | 0 | 0 | 112.6 | V167 F245 V246 N251 | V167-L249 HydrophobicContact CG1-CD2 4.3Å; V167-L249 HydrophobicContact CG2-CD2 4.11Å; F245-L249 HydrophobicContact CD1-CD1 4.18Å; F245-L249 HydrophobicContact CE1-CD1 3.59Å; F245-L249 HydrophobicContact CE1-CG 4.38Å; F245-L249 HydrophobicContact CE2-CD1 4.32Å; F245-L249 HydrophobicContact CE2-CD2 4.41Å; F245-L249 HydrophobicContact CE2-CG 4.35Å; F245-L249 HydrophobicContact CZ-CD1 3.68Å; F245-L249 HydrophobicContact CZ-CD2 4.38Å; F245-L249 HydrophobicContact CZ-CG 4.19Å; F245-L249 WeakPolarHBondContact O-CG 3.22Å; F245-L249 PolarHBondContact O-N 3.24Å; V246-L249 PolarHBondContact O-N 3.45Å; L249-N251 VanDerWaalsContact C-N 3.27Å; L249-N251 PolarHBondContact O-N 3.29Å |
| 250 | C | 89.6 | Confident | 88.9 | Confident | 89 Ų | 89 | 57.2 Ų | 57.2 | 60% | 0.601 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.8 | 1.7 | 175.8 | -66.6 | 0 | 0 | 0 | 0 | 113.8 | V246 L247 T248 S252 | V246-C250 PolarHBondContact O-N 3.05Å; V246-C250 PolarHBondContact O-SG 3.48Å; L247-C250 CarbonylContact O-C 3.59Å; L247-C250 PolarHBondContact O-N 3.37Å; T248-C250 PolarHBondContact O-N 3.07Å; C250-S252 PolarHBondContact O-N 3.47Å |
| 251 | N | 86.1 | Confident | 88.6 | Confident | 150 Ų | 150 | 53.1 Ų | 53.1 | 80% | 0.802 | 31% | 0.312 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 35.8 | -172.7 | -64.5 | -64.4 | 0 | 0 | 0 | 113.1 | L247 T248 L249 | L247-N251 PolarHBondContact O-N 3.37Å; T248-N251 PolarHBondContact O-N 3.36Å; L249-N251 VanDerWaalsContact C-N 3.27Å; L249-N251 PolarHBondContact O-N 3.29Å |
| 252 | S | 88.4 | Confident | 88.6 | Confident | 35 Ų | 35 | 54.4 Ų | 54.4 | 25% | 0.245 | 32% | 0.32 | C | S | . | . | trans | -82.2 | 130.5 | -177.5 | -176.5 | 0 | 0 | 0 | 0 | 111 | L247 C250 A254 V255 | L247-S252 PolarHBondContact O-N 2.94Å; C250-S252 PolarHBondContact O-N 3.47Å; S252-A254 PolarHBondContact O-N 3.44Å; S252-A254 VanDerWaalsContact O-N 3.11Å; S252-A254 PolarHBondContact OG-N 3.31Å; S252-V255 WeakPolarHBondContact O-CG1 3.5Å; S252-V255 PolarHBondContact O-N 2.84Å | ||
| 253 | P | 85.4 | Confident | 88.7 | Confident | 115 Ų | 115 | 55.8 Ų | 55.8 | 75% | 0.747 | 33% | 0.326 | S | S | * | . | G | 310 helix | trans | -64.4 | -17.4 | 176.2 | 27.6 | -35 | 0 | 0 | 0 | 112.7 | V255 R256 | P253-V255 PolarHBondContact O-N 2.02Å; P253-V255 VanDerWaalsContact O-N 3.13Å; P253-R256 PolarHBondContact O-N 3.25Å |
| 254 | A | 87.4 | Confident | 88.7 | Confident | 35 Ų | 35 | 53.4 Ų | 53.4 | 29% | 0.289 | 31% | 0.311 | S | S | . | . | G | 310 helix | trans | -61.7 | -18.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | L247 S252 R256 T257 L260 | L247-A254 HydrophobicContact CD1-CB 4.33Å; L247-A254 HydrophobicContact CD2-CB 4.44Å; S252-A254 PolarHBondContact O-N 3.44Å; S252-A254 VanDerWaalsContact O-N 3.11Å; S252-A254 PolarHBondContact OG-N 3.31Å; A254-R256 PolarHBondContact O-N 3.34Å; A254-R256 VanDerWaalsContact O-N 3.12Å; A254-T257 WeakPolarHBondContact O-CB 3.33Å; A254-T257 PolarHBondContact O-N 2.96Å; A254-T257 PolarHBondContact O-OG1 3.19Å; A254-L260 WeakPolarHBondContact O-CD1 3.41Å |
| 255 | V | 84.2 | Confident | 88.8 | Confident | 15 Ų | 15 | 53.2 Ų | 53.2 | 9% | 0.091 | 31% | 0.311 | C | S | . | . | G | 310 helix | trans | -57 | -27.8 | 175.1 | 72.9 | 0 | 0 | 0 | 0 | 112.2 | R244 L247 S252 P253 | R244-V255 HydrophobicContact CB-CG2 4.35Å; R244-V255 HydrophobicContact CG-CG2 4.46Å; R244-V255 PolarHBondContact NH1-O 3.47Å; R244-V255 PolarHBondContact NH2-O 2.92Å; L247-V255 HydrophobicContact CB-CB 4.11Å; L247-V255 HydrophobicContact CB-CG2 4.45Å; S252-V255 WeakPolarHBondContact O-CG1 3.5Å; S252-V255 PolarHBondContact O-N 2.84Å; P253-V255 PolarHBondContact O-N 2.02Å; P253-V255 VanDerWaalsContact O-N 3.13Å |
| 256 | R | 82.8 | Confident | 89 | Confident | 97 Ų | 97 | 55.3 Ų | 55.3 | 37% | 0.366 | 32% | 0.322 | S | S | . | . | G | 310 helix | trans | -88.4 | 3 | -179.1 | -62.3 | -177.4 | 175.1 | -168.5 | -12.5 | 114.1 | A5 P6 D151 P253 A254 P258 | A5-R256 VanDerWaalsContact CB-NH2 3.33Å; P6-R256 PolarHBondContact O-NH2 3.49Å; D151-R256 IonicContact OD1-NH2 3.45Å; D151-R256 PolarHBondContact OD1-NH2 3.45Å; P253-R256 PolarHBondContact O-N 3.25Å; A254-R256 PolarHBondContact O-N 3.34Å; A254-R256 VanDerWaalsContact O-N 3.12Å; R256-P258 WeakPolarHBondContact O-CD 3.4Å |
| 257 | T | 88.1 | Confident | 89 | Confident | 61 Ų | 61 | 52 Ų | 52 | 37% | 0.374 | 30% | 0.302 | S | S | . | . | trans | -63.2 | 124.7 | 179.1 | -59 | 0 | 0 | 0 | 0 | 110.7 | A254 V259 L260 V261 | A254-T257 WeakPolarHBondContact O-CB 3.33Å; A254-T257 PolarHBondContact O-N 2.96Å; A254-T257 PolarHBondContact O-OG1 3.19Å; T257-V259 VanDerWaalsContact C-N 3.25Å; T257-V259 HydrophobicContact CG2-CB 4.4Å; T257-V259 PolarHBondContact O-N 3.46Å; T257-V259 VanDerWaalsContact O-N 3.12Å; T257-L260 PolarHBondContact O-N 2.88Å; T257-V261 WeakPolarHBondContact O-CG2 3.47Å; T257-V261 PolarHBondContact O-N 3.24Å; T257-V261 VanDerWaalsContact O-N 3.11Å | ||
| 258 | P | 86.2 | Confident | 89.1 | Confident | 77 Ų | 77 | 50.7 Ų | 50.7 | 50% | 0.5 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -51.3 | -41 | -176 | -33.7 | 38.2 | 0 | 0 | 0 | 114.3 | E14 R256 L260 V261 V262 | E14-P258 VanDerWaalsContact OE1-CA 3.23Å; E14-P258 WeakPolarHBondContact OE1-CA 3.48Å; E14-P258 WeakPolarHBondContact OE1-CB 3.43Å; R256-P258 WeakPolarHBondContact O-CD 3.4Å; P258-L260 VanDerWaalsContact C-N 3.33Å; P258-L260 PolarHBondContact O-N 3.04Å; P258-V261 WeakPolarHBondContact O-CB 3.37Å; P258-V261 PolarHBondContact O-N 2.83Å; P258-V262 WeakPolarHBondContact O-CG2 3.31Å; P258-V262 PolarHBondContact O-N 3.33Å |
| 259 | V | 90.7 | Very high | 89.4 | Confident | 96 Ų | 96 | 49.2 Ų | 49.2 | 58% | 0.582 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -60.1 | -42.6 | 178.4 | 177.3 | 0 | 0 | 0 | 0 | 111.5 | T257 L263 | T257-V259 VanDerWaalsContact C-N 3.25Å; T257-V259 HydrophobicContact CG2-CB 4.4Å; T257-V259 PolarHBondContact O-N 3.46Å; T257-V259 VanDerWaalsContact O-N 3.12Å; V259-L263 HydrophobicContact CG1-CD1 3.74Å; V259-L263 HydrophobicContact CG1-CG 4.35Å; V259-L263 WeakPolarHBondContact O-CB 3.47Å; V259-L263 WeakPolarHBondContact O-CG 3.33Å; V259-L263 PolarHBondContact O-N 3.38Å |
| 260 | L | 90.2 | Very high | 89.7 | Confident | 29 Ų | 29 | 47.5 Ų | 47.5 | 15% | 0.152 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -70.7 | -35.8 | 178.2 | -70.6 | 175.7 | 0 | 0 | 0 | 111.8 | W240 V243 R244 L247 A254 T257 P258 H264 | W240-L260 HydrophobicContact CE3-CD2 4.31Å; V243-L260 HydrophobicContact CG1-CD2 4.25Å; R244-L260 WeakPolarHBondContact CD-O 3.48Å; R244-L260 HydrophobicContact CG-CB 4.25Å; L247-L260 HydrophobicContact CD1-CD1 3.69Å; A254-L260 WeakPolarHBondContact O-CD1 3.41Å; T257-L260 PolarHBondContact O-N 2.88Å; P258-L260 VanDerWaalsContact C-N 3.33Å; P258-L260 PolarHBondContact O-N 3.04Å; L260-H264 VanDerWaalsContact O-CB 3.25Å; L260-H264 WeakPolarHBondContact O-CB 3.36Å; L260-H264 PolarHBondContact O-N 2.94Å |
| 261 | V | 88.6 | Confident | 89.9 | Confident | 3 Ų | 3 | 43.3 Ų | 43.3 | 2% | 0.018 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -57.8 | -53.8 | 173.5 | 180 | 0 | 0 | 0 | 0 | 109.9 | L10 V154 T257 P258 H264 G265 | L10-V261 HydrophobicContact CD2-CG1 3.33Å; V154-V261 HydrophobicContact CG1-CG1 3.64Å; V154-V261 HydrophobicContact CG2-CG1 4.44Å; T257-V261 WeakPolarHBondContact O-CG2 3.47Å; T257-V261 PolarHBondContact O-N 3.24Å; T257-V261 VanDerWaalsContact O-N 3.11Å; P258-V261 WeakPolarHBondContact O-CB 3.37Å; P258-V261 PolarHBondContact O-N 2.83Å; V261-H264 PolarHBondContact O-N 2.9Å; V261-G265 PolarHBondContact O-N 3.38Å |
| 262 | V | 91.3 | Very high | 90.2 | Very high | 32 Ų | 32 | 36.2 Ų | 36.2 | 19% | 0.194 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -62.5 | -46.6 | -179.9 | 174.2 | 0 | 0 | 0 | 0 | 111.7 | E14 V17 P258 H264 G265 I266 | E14-V262 HydrophobicContact CB-CG2 4.16Å; E14-V262 HydrophobicContact CG-CG2 3.69Å; V17-V262 HydrophobicContact CB-CG1 4.37Å; V17-V262 HydrophobicContact CG1-CG1 3.67Å; P258-V262 WeakPolarHBondContact O-CG2 3.31Å; P258-V262 PolarHBondContact O-N 3.33Å; V262-H264 VanDerWaalsContact C-N 3.32Å; V262-H264 PolarHBondContact O-N 3.22Å; V262-G265 PolarHBondContact O-N 2.96Å; V262-G265 VanDerWaalsContact O-N 3.15Å; V262-I266 HydrophobicContact CG1-CD1 3.7Å; V262-I266 HydrophobicContact CG1-CG1 4.27Å; V262-I266 WeakPolarHBondContact O-CG1 3.19Å; V262-I266 PolarHBondContact O-N 3.45Å |
| 263 | L | 93.7 | Very high | 90.3 | Very high | 50 Ų | 50 | 34.8 Ų | 34.8 | 26% | 0.262 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -64.1 | -37.1 | -179.2 | -73.2 | 172.5 | 0 | 0 | 0 | 112.2 | W240 V259 G267 | W240-L263 HydrophobicContact CB-CB 4.03Å; W240-L263 HydrophobicContact CD2-CB 3.71Å; W240-L263 HydrophobicContact CD2-CD1 3.94Å; W240-L263 HydrophobicContact CD2-CG 4.29Å; W240-L263 HydrophobicContact CE3-CB 4.08Å; W240-L263 HydrophobicContact CE3-CD1 3.72Å; W240-L263 HydrophobicContact CE3-CG 4.49Å; W240-L263 HydrophobicContact CG-CB 3.67Å; W240-L263 HydrophobicContact CH2-CD1 3.82Å; W240-L263 HydrophobicContact CZ2-CD1 4.03Å; W240-L263 HydrophobicContact CZ2-CD2 4.4Å; W240-L263 HydrophobicContact CZ3-CD1 3.66Å; V259-L263 HydrophobicContact CG1-CD1 3.74Å; V259-L263 HydrophobicContact CG1-CG 4.35Å; V259-L263 WeakPolarHBondContact O-CB 3.47Å; V259-L263 WeakPolarHBondContact O-CG 3.33Å; V259-L263 PolarHBondContact O-N 3.38Å; L263-G267 WeakPolarHBondContact O-CA 3.49Å; L263-G267 PolarHBondContact O-N 2.7Å |
| 264 | H | 93.2 | Very high | 90.6 | Very high | 3 Ų | 3 | 29.7 Ų | 29.7 | 1% | 0.014 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64.8 | -46 | 171.1 | 177.4 | -162.1 | 0 | 0 | 0 | 111.5 | V152 V154 W240 S241 R244 L260 V261 V262 I266 G267 N268 | V152-H264 PolarHBondContact O-CE1 2.85Å; V154-H264 HydrophobicContact CG2-CB 3.95Å; V154-H264 VanDerWaalsContact CG2-ND1 3.31Å; V154-H264 WeakPolarHBondContact CG2-ND1 3.47Å; W240-H264 HydrophobicContact CB-CB 4.48Å; S241-H264 VanDerWaalsContact CA-CD2 3.42Å; S241-H264 WeakPolarHBondContact CA-CD2 3.4Å; S241-H264 WeakPolarHBondContact CB-CD2 3.48Å; S241-H264 WeakPolarHBondContact CB-NE2 3.42Å; S241-H264 PolarHBondContact OG-CD2 3.21Å; S241-H264 VanDerWaalsContact OG-CD2 3.25Å; S241-H264 PolarHBondContact OG-NE2 3.03Å; R244-H264 VanDerWaalsContact CD-ND1 3.29Å; R244-H264 WeakPolarHBondContact CD-ND1 3.19Å; R244-H264 HydrophobicContact CG-CB 4.48Å; R244-H264 PolarHBondContact NE-ND1 2.9Å; L260-H264 VanDerWaalsContact O-CB 3.25Å; L260-H264 WeakPolarHBondContact O-CB 3.36Å; L260-H264 PolarHBondContact O-N 2.94Å; V261-H264 PolarHBondContact O-N 2.9Å; V262-H264 VanDerWaalsContact C-N 3.32Å; V262-H264 PolarHBondContact O-N 3.22Å; H264-I266 PolarHBondContact O-N 2.74Å; H264-G267 PolarHBondContact O-N 3.48Å; H264-N268 PolarHBondContact CD2-ND2 2.89Å; H264-N268 PolarHBondContact NE2-ND2 3.29Å; H264-N268 PolarHBondContact O-N 2.66Å |
| 265 | G | 91.8 | Very high | 90.8 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -56.1 | -50.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | V261 V262 T269 | V261-G265 PolarHBondContact O-N 3.38Å; V262-G265 PolarHBondContact O-N 2.96Å; V262-G265 VanDerWaalsContact O-N 3.15Å; G265-T269 WeakPolarHBondContact O-CB 3.43Å; G265-T269 WeakPolarHBondContact O-CG2 3.37Å; G265-T269 PolarHBondContact O-N 2.87Å; G265-T269 PolarHBondContact O-OG1 3.19Å |
| 266 | I | 94.4 | Very high | 91.1 | Very high | 52 Ų | 52 | 27.7 Ų | 27.7 | 27% | 0.267 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -63.5 | -47.5 | 174.9 | -64.6 | 169.9 | 0 | 0 | 0 | 110.4 | V17 V262 H264 N268 T269 F270 | V17-I266 HydrophobicContact CG1-CD1 3.73Å; V17-I266 HydrophobicContact CG1-CG1 3.93Å; V262-I266 HydrophobicContact CG1-CD1 3.7Å; V262-I266 HydrophobicContact CG1-CG1 4.27Å; V262-I266 WeakPolarHBondContact O-CG1 3.19Å; V262-I266 PolarHBondContact O-N 3.45Å; H264-I266 PolarHBondContact O-N 2.74Å; I266-N268 VanDerWaalsContact C-N 3.31Å; I266-N268 PolarHBondContact O-N 3.49Å; I266-T269 PolarHBondContact O-N 3.35Å; I266-T269 PolarHBondContact O-OG1 3.5Å; I266-F270 HydrophobicContact CG2-CB 4.03Å; I266-F270 WeakPolarHBondContact O-CB 3.2Å; I266-F270 PolarHBondContact O-N 2.96Å |
| 267 | G | 93.1 | Very high | 91.3 | Very high | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -57.7 | -40.1 | -175.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | L237 R238 L263 H264 | L237-G267 WeakPolarHBondContact O-CA 3.04Å; R238-G267 WeakPolarHBondContact CD-O 3.34Å; L263-G267 WeakPolarHBondContact O-CA 3.49Å; L263-G267 PolarHBondContact O-N 2.7Å; H264-G267 PolarHBondContact O-N 3.48Å |
| 268 | N | 91.5 | Very high | 91.1 | Very high | 9 Ų | 9 | 24.8 Ų | 24.8 | 5% | 0.048 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -79.6 | -29.1 | 178.6 | -84.2 | 4 | 0 | 0 | 0 | 113.5 | Y64 W156 S241 H264 I266 | Y64-N268 HydrophobicContact CE2-CB 4.36Å; W156-N268 HydrophobicContact CH2-CB 4.24Å; W156-N268 HydrophobicContact CZ2-CB 4.33Å; S241-N268 WeakPolarHBondContact CB-OD1 3.26Å; H264-N268 PolarHBondContact CD2-ND2 2.89Å; H264-N268 PolarHBondContact NE2-ND2 3.29Å; H264-N268 PolarHBondContact O-N 2.66Å; I266-N268 VanDerWaalsContact C-N 3.31Å; I266-N268 PolarHBondContact O-N 3.49Å |
| 269 | T | 93.6 | Very high | 91 | Very high | 3 Ų | 3 | 21.4 Ų | 21.4 | 2% | 0.018 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -98.1 | -31.5 | -170.5 | 59.6 | 0 | 0 | 0 | 0 | 112.8 | V18 S21 C22 S25 Y64 W156 G265 I266 Q271 | V18-T269 HydrophobicContact CG1-CG2 4.23Å; S21-T269 WeakPolarHBondContact CB-OG1 3.42Å; S21-T269 PolarHBondContact OG-OG1 3.46Å; C22-T269 VanDerWaalsContact SG-CB 3.55Å; C22-T269 WeakPolarHBondContact SG-CG2 3.06Å; S25-T269 WeakPolarHBondContact CB-O 3.43Å; S25-T269 PolarHBondContact OG-O 2.93Å; Y64-T269 HydrophobicContact CD2-CG2 3.72Å; Y64-T269 HydrophobicContact CG-CG2 3.95Å; W156-T269 HydrophobicContact CZ3-CG2 4.29Å; G265-T269 WeakPolarHBondContact O-CB 3.43Å; G265-T269 WeakPolarHBondContact O-CG2 3.37Å; G265-T269 PolarHBondContact O-N 2.87Å; G265-T269 PolarHBondContact O-OG1 3.19Å; I266-T269 PolarHBondContact O-N 3.35Å; I266-T269 PolarHBondContact O-OG1 3.5Å; T269-Q271 VanDerWaalsContact C-N 3.32Å; T269-Q271 PolarHBondContact O-N 3.46Å |
| 270 | F | 94.4 | Very high | 90.5 | Very high | 46 Ų | 46 | 16.9 Ų | 16.9 | 20% | 0.202 | 9% | 0.09 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -80.8 | 0.2 | -168.8 | -163.5 | -116.8 | 0 | 0 | 0 | 115.9 | S21 L24 L237 I266 G272 G273 A274 I277 | S21-F270 WeakPolarHBondContact OG-CB 3.48Å; L24-F270 HydrophobicContact CB-CD2 4.4Å; L24-F270 HydrophobicContact CB-CE2 3.92Å; L24-F270 HydrophobicContact CD1-CE2 4.15Å; L237-F270 HydrophobicContact CD2-CB 4.44Å; L237-F270 HydrophobicContact CD2-CD1 4.22Å; I266-F270 HydrophobicContact CG2-CB 4.03Å; I266-F270 WeakPolarHBondContact O-CB 3.2Å; I266-F270 PolarHBondContact O-N 2.96Å; F270-G272 VanDerWaalsContact C-N 3.34Å; F270-G272 PolarHBondContact O-N 3Å; F270-G273 PolarHBondContact O-N 3.19Å; F270-A274 HydrophobicContact CD1-CB 4.17Å; F270-A274 HydrophobicContact CE1-CB 4.19Å; F270-A274 PolarHBondContact O-N 2.91Å; F270-I277 HydrophobicContact CE1-CD1 4.31Å; F270-I277 HydrophobicContact CZ-CD1 4.06Å |
| 271 | Q | 92.9 | Very high | 90.1 | Very high | 2 Ų | 2 | 19.6 Ų | 19.6 | 1% | 0.009 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -53.5 | -46.9 | -174 | -172.7 | 68.3 | 17.2 | 0 | 0 | 113 | T269 G273 A274 N275 | T269-Q271 VanDerWaalsContact C-N 3.32Å; T269-Q271 PolarHBondContact O-N 3.46Å; Q271-G273 VanDerWaalsContact C-N 3.34Å; Q271-G273 PolarHBondContact O-N 2.92Å; Q271-A274 PolarHBondContact O-N 3.45Å; Q271-N275 PolarHBondContact O-N 3.48Å; Q271-N275 PolarHBondContact O-ND2 2.71Å |
| 272 | G | 91.5 | Very high | 89.8 | Confident | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -63.8 | -37.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S25 S29 F270 N275 C276 | S25-G272 WeakPolarHBondContact OG-CA 3.22Å; S25-G272 PolarHBondContact OG-N 3.04Å; S25-G272 VanDerWaalsContact OG-N 3.13Å; S29-G272 VanDerWaalsContact OG-CA 3.28Å; S29-G272 WeakPolarHBondContact OG-CA 3.3Å; F270-G272 VanDerWaalsContact C-N 3.34Å; F270-G272 PolarHBondContact O-N 3Å; G272-N275 PolarHBondContact O-N 2.85Å; G272-C276 WeakPolarHBondContact O-CB 3.4Å; G272-C276 PolarHBondContact O-N 3.36Å |
| 273 | G | 92.5 | Very high | 89.2 | Confident | 5 Ų | 5 | 21.6 Ų | 21.6 | 5% | 0.052 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -63.7 | -46.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | S25 F270 Q271 N275 C276 I277 | S25-G273 PolarHBondContact OG-N 3.49Å; F270-G273 PolarHBondContact O-N 3.19Å; Q271-G273 VanDerWaalsContact C-N 3.34Å; Q271-G273 PolarHBondContact O-N 2.92Å; G273-N275 PolarHBondContact O-N 3.15Å; G273-C276 WeakPolarHBondContact O-CB 3.38Å; G273-C276 PolarHBondContact O-N 3.2Å; G273-C276 VanDerWaalsContact O-N 3.16Å; G273-I277 WeakPolarHBondContact O-CG1 3.47Å; G273-I277 PolarHBondContact O-N 3.11Å |
| 274 | A | 91.6 | Very high | 88.5 | Confident | 8 Ų | 8 | 28.5 Ų | 28.5 | 7% | 0.066 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.2 | -40 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I233 L237 F270 Q271 C276 I277 M278 | I233-A274 HydrophobicContact CG2-CB 3.5Å; L237-A274 HydrophobicContact CD1-CB 3.82Å; F270-A274 HydrophobicContact CD1-CB 4.17Å; F270-A274 HydrophobicContact CE1-CB 4.19Å; F270-A274 PolarHBondContact O-N 2.91Å; Q271-A274 PolarHBondContact O-N 3.45Å; A274-C276 VanDerWaalsContact C-N 3.34Å; A274-C276 PolarHBondContact O-N 3.11Å; A274-I277 PolarHBondContact O-N 3.19Å; A274-M278 PolarHBondContact O-N 3.12Å |
| 275 | N | 91.1 | Very high | 87.7 | Confident | 0 Ų | 0 | 31.1 Ų | 31.1 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.6 | -44.5 | 171.8 | -74.9 | -30.3 | 0 | 0 | 0 | 111.3 | L32 D57 Q271 G272 G273 M278 F279 | L32-N275 HydrophobicContact CD1-CB 3.93Å; D57-N275 PolarHBondContact OD2-ND2 2.91Å; Q271-N275 PolarHBondContact O-N 3.48Å; Q271-N275 PolarHBondContact O-ND2 2.71Å; G272-N275 PolarHBondContact O-N 2.85Å; G273-N275 PolarHBondContact O-N 3.15Å; N275-M278 PolarHBondContact O-N 2.9Å; N275-F279 WeakPolarHBondContact O-CD2 3.38Å; N275-F279 PolarHBondContact O-N 3.47Å |
| 276 | C | 90.2 | Very high | 87.2 | Confident | 8 Ų | 8 | 31.3 Ų | 31.3 | 5% | 0.054 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -61.4 | -46.5 | 177.9 | 179.6 | 0 | 0 | 0 | 0 | 112.6 | G28 L32 G272 G273 A274 M278 F279 V280 L281 | G28-C276 WeakPolarHBondContact O-CB 3.49Å; L32-C276 HydrophobicContact CD1-CB 4.27Å; L32-C276 HydrophobicContact CG-CB 4.43Å; G272-C276 WeakPolarHBondContact O-CB 3.4Å; G272-C276 PolarHBondContact O-N 3.36Å; G273-C276 WeakPolarHBondContact O-CB 3.38Å; G273-C276 PolarHBondContact O-N 3.2Å; G273-C276 VanDerWaalsContact O-N 3.16Å; A274-C276 VanDerWaalsContact C-N 3.34Å; A274-C276 PolarHBondContact O-N 3.11Å; C276-M278 PolarHBondContact O-N 2.96Å; C276-F279 PolarHBondContact O-N 3.42Å; C276-V280 WeakPolarHBondContact O-CA 3.41Å; C276-V280 VanDerWaalsContact O-CB 3.23Å; C276-V280 WeakPolarHBondContact O-CB 3.37Å; C276-V280 PolarHBondContact O-N 2.96Å; C276-L281 PolarHBondContact O-N 2.94Å |
| 277 | I | 87.8 | Confident | 86.8 | Confident | 73 Ų | 73 | 33.8 Ų | 33.8 | 37% | 0.374 | 17% | 0.17 | S | C | . | . | I | π-helix | trans | -52.2 | -47.5 | 176.8 | -68.9 | 165.8 | 0 | 0 | 0 | 109.9 | F270 G273 A274 L281 C282 | F270-I277 HydrophobicContact CE1-CD1 4.31Å; F270-I277 HydrophobicContact CZ-CD1 4.06Å; G273-I277 WeakPolarHBondContact O-CG1 3.47Å; G273-I277 PolarHBondContact O-N 3.11Å; A274-I277 PolarHBondContact O-N 3.19Å; I277-L281 HydrophobicContact CG1-CD1 4.1Å; I277-L281 PolarHBondContact O-N 3.07Å; I277-C282 WeakPolarHBondContact O-CB 3.4Å; I277-C282 PolarHBondContact O-N 3.03Å; I277-C282 PolarHBondContact O-SG 2.92Å |
| 278 | M | 84.1 | Confident | 86.3 | Confident | 24 Ų | 24 | 37.8 Ų | 37.8 | 12% | 0.118 | 19% | 0.194 | C | C | . | . | I | π-helix | trans | -69 | -47 | -177.3 | -73.7 | -55.7 | -59 | 0 | 0 | 114.3 | K226 L229 I233 A274 N275 C276 T283 | K226-M278 HydrophobicContact CB-CE 4Å; K226-M278 HydrophobicContact CD-CE 4.42Å; K226-M278 HydrophobicContact CG-CE 4.21Å; K226-M278 PolarHBondContact NZ-O 3.27Å; L229-M278 HydrophobicContact CB-CE 4.17Å; L229-M278 HydrophobicContact CD2-CE 3.49Å; L229-M278 VanDerWaalsContact CD2-CE 3.49Å; L229-M278 HydrophobicContact CD2-SD 3.69Å; L229-M278 HydrophobicContact CG-CE 4.37Å; I233-M278 HydrophobicContact CD1-CG 3.46Å; I233-M278 VanDerWaalsContact CD1-CG 3.46Å; I233-M278 HydrophobicContact CD1-SD 4.14Å; A274-M278 PolarHBondContact O-N 3.12Å; N275-M278 PolarHBondContact O-N 2.9Å; C276-M278 PolarHBondContact O-N 2.96Å; M278-T283 PolarHBondContact O-OG1 2.54Å |
| 279 | F | 82.5 | Confident | 86.1 | Confident | 6 Ų | 6 | 41.6 Ų | 41.6 | 3% | 0.026 | 21% | 0.208 | C | C | . | . | I | π-helix | trans | -95 | -23.7 | -168.8 | -68.7 | -68.3 | 0 | 0 | 0 | 114.3 | L32 L50 K226 L227 I230 N275 C276 T283 | L32-F279 HydrophobicContact CD2-CB 3.82Å; L50-F279 HydrophobicContact CD1-CD2 4Å; L50-F279 HydrophobicContact CD1-CE2 4.23Å; L50-F279 HydrophobicContact CD2-CB 3.79Å; L50-F279 HydrophobicContact CD2-CD1 3.97Å; L50-F279 HydrophobicContact CD2-CD2 3.59Å; L50-F279 HydrophobicContact CD2-CE2 4.31Å; L50-F279 HydrophobicContact CD2-CG 3.45Å; L50-F279 VanDerWaalsContact CD2-CG 3.45Å; L50-F279 HydrophobicContact CG-CD2 4.47Å; K226-F279 HydrophobicContact CB-CE1 4.09Å; K226-F279 HydrophobicContact CB-CZ 4.47Å; L227-F279 HydrophobicContact CB-CZ 4.44Å; L227-F279 HydrophobicContact CD2-CD1 4.49Å; L227-F279 HydrophobicContact CD2-CE1 3.49Å; L227-F279 VanDerWaalsContact CD2-CE1 3.49Å; L227-F279 HydrophobicContact CD2-CE2 4.29Å; L227-F279 HydrophobicContact CD2-CZ 3.4Å; L227-F279 VanDerWaalsContact CD2-CZ 3.4Å; L227-F279 HydrophobicContact CG-CE1 3.76Å; L227-F279 HydrophobicContact CG-CZ 3.93Å; I230-F279 HydrophobicContact CD1-CE2 3.51Å; I230-F279 HydrophobicContact CD1-CZ 3.53Å; I230-F279 HydrophobicContact CG1-CE2 3.65Å; I230-F279 HydrophobicContact CG1-CZ 3.75Å; N275-F279 WeakPolarHBondContact O-CD2 3.38Å; N275-F279 PolarHBondContact O-N 3.47Å; C276-F279 PolarHBondContact O-N 3.42Å; F279-T283 WeakPolarHBondContact O-CB 3.48Å; F279-T283 PolarHBondContact O-OG1 3.34Å |
| 280 | V | 81.8 | Confident | 85.7 | Confident | 1 Ų | 1 | 43.2 Ų | 43.2 | 1% | 0.006 | 22% | 0.216 | C | C | . | . | I | π-helix | trans | -101.9 | -67.6 | 176.9 | -174.5 | 0 | 0 | 0 | 0 | 109.8 | L31 L32 C276 C282 T283 V286 L290 | L31-V280 HydrophobicContact CD2-CG1 3.69Å; L31-V280 HydrophobicContact CG-CG1 4.04Å; L31-V280 HydrophobicContact CG-CG2 4.43Å; L32-V280 HydrophobicContact CD2-CG2 3.47Å; L32-V280 VanDerWaalsContact CD2-CG2 3.47Å; L32-V280 HydrophobicContact CG-CG2 3.89Å; C276-V280 WeakPolarHBondContact O-CA 3.41Å; C276-V280 VanDerWaalsContact O-CB 3.23Å; C276-V280 WeakPolarHBondContact O-CB 3.37Å; C276-V280 PolarHBondContact O-N 2.96Å; V280-C282 PolarHBondContact O-N 3.19Å; V280-T283 PolarHBondContact O-N 3.13Å; V280-T283 VanDerWaalsContact O-N 3.1Å; V280-V286 HydrophobicContact CB-CG1 4.11Å; V280-V286 HydrophobicContact CG1-CG1 3.51Å; V280-V286 HydrophobicContact CG2-CG1 4.5Å; V280-L290 HydrophobicContact CG1-CD1 3.4Å; V280-L290 VanDerWaalsContact CG1-CD1 3.4Å |
| 281 | L | 81.3 | Confident | 85.3 | Confident | 87 Ų | 87 | 47 Ų | 47 | 46% | 0.455 | 23% | 0.233 | S | C | . | . | I | π-helix | trans | -69.3 | -41.9 | -167.5 | -56 | -176.2 | 0 | 0 | 0 | 112.8 | C276 I277 T283 R287 | C276-L281 PolarHBondContact O-N 2.94Å; I277-L281 HydrophobicContact CG1-CD1 4.1Å; I277-L281 PolarHBondContact O-N 3.07Å; L281-T283 PolarHBondContact O-N 3.29Å; L281-R287 PolarHBondContact O-NH1 3.05Å |
| 282 | C | 80.8 | Confident | 84.9 | Confident | 65 Ų | 65 | 50.1 Ų | 50.1 | 44% | 0.439 | 26% | 0.255 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.5 | -9.2 | 176.4 | -65.5 | 0 | 0 | 0 | 0 | 112.4 | K226 I277 V280 | K226-C282 PolarHBondContact NZ-O 3.35Å; I277-C282 WeakPolarHBondContact O-CB 3.4Å; I277-C282 PolarHBondContact O-N 3.03Å; I277-C282 PolarHBondContact O-SG 2.92Å; V280-C282 PolarHBondContact O-N 3.19Å |
| 283 | T | 79.9 | Confident | 84.6 | Confident | 12 Ų | 12 | 54.1 Ų | 54.1 | 7% | 0.074 | 28% | 0.276 | C | S | . | . | trans | -97.8 | 102.6 | -176.7 | -61.1 | 0 | 0 | 0 | 0 | 110.8 | K226 M278 F279 V280 L281 A285 V286 R287 | K226-T283 PolarHBondContact NZ-OG1 2.9Å; M278-T283 PolarHBondContact O-OG1 2.54Å; F279-T283 WeakPolarHBondContact O-CB 3.48Å; F279-T283 PolarHBondContact O-OG1 3.34Å; V280-T283 PolarHBondContact O-N 3.13Å; V280-T283 VanDerWaalsContact O-N 3.1Å; L281-T283 PolarHBondContact O-N 3.29Å; T283-A285 VanDerWaalsContact C-N 3.29Å; T283-A285 PolarHBondContact O-N 3.47Å; T283-A285 VanDerWaalsContact O-N 3.15Å; T283-V286 HydrophobicContact CG2-CB 4.25Å; T283-V286 HydrophobicContact CG2-CG2 3.92Å; T283-V286 PolarHBondContact O-N 3.23Å; T283-R287 PolarHBondContact O-N 3.36Å | ||
| 284 | R | 77.8 | Confident | 84.1 | Confident | 195 Ų | 195 | 57.5 Ų | 57.5 | 74% | 0.736 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -48.7 | -46.7 | -175.8 | -169.6 | 178.1 | -176.8 | -177.5 | 1.8 | 113.4 | V286 R287 T288 | R284-V286 VanDerWaalsContact C-N 3.31Å; R284-V286 PolarHBondContact O-N 3.1Å; R284-R287 PolarHBondContact O-N 3.19Å; R284-T288 WeakPolarHBondContact O-CB 3.23Å; R284-T288 PolarHBondContact O-N 3.21Å; R284-T288 PolarHBondContact O-OG1 3.26Å; R284-T288 VanDerWaalsContact O-OG1 3.04Å |
| 285 | A | 78.1 | Confident | 83.3 | Confident | 58 Ų | 58 | 60.6 Ų | 60.6 | 48% | 0.479 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -59.3 | -39.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | T283 R289 | T283-A285 VanDerWaalsContact C-N 3.29Å; T283-A285 PolarHBondContact O-N 3.47Å; T283-A285 VanDerWaalsContact O-N 3.15Å; A285-R289 WeakPolarHBondContact O-CG 3.42Å |
| 286 | V | 79.7 | Confident | 81.9 | Confident | 3 Ų | 3 | 64.5 Ų | 64.5 | 2% | 0.018 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -73.8 | -47.5 | 178.2 | 169.7 | 0 | 0 | 0 | 0 | 110.2 | T35 W39 L42 V280 T283 R284 T288 R289 L290 | T35-V286 HydrophobicContact CG2-CG1 4.27Å; W39-V286 HydrophobicContact CZ3-CG1 3.97Å; L42-V286 HydrophobicContact CD1-CG2 3.74Å; V280-V286 HydrophobicContact CB-CG1 4.11Å; V280-V286 HydrophobicContact CG1-CG1 3.51Å; V280-V286 HydrophobicContact CG2-CG1 4.5Å; T283-V286 HydrophobicContact CG2-CB 4.25Å; T283-V286 HydrophobicContact CG2-CG2 3.92Å; T283-V286 PolarHBondContact O-N 3.23Å; R284-V286 VanDerWaalsContact C-N 3.31Å; R284-V286 PolarHBondContact O-N 3.1Å; V286-T288 PolarHBondContact O-N 3.14Å; V286-R289 PolarHBondContact O-N 3.31Å; V286-L290 HydrophobicContact CG1-CD1 4.1Å; V286-L290 HydrophobicContact CG1-CG 4.47Å; V286-L290 PolarHBondContact O-N 2.93Å |
| 287 | R | 86.7 | Confident | 80.3 | Confident | 105 Ų | 105 | 69 Ų | 69 | 40% | 0.396 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -58.6 | -43.5 | -180 | -174.8 | 175.9 | 72.1 | -151.8 | 8.9 | 112.7 | L281 T283 R284 R289 L290 F291 | L281-R287 PolarHBondContact O-NH1 3.05Å; T283-R287 PolarHBondContact O-N 3.36Å; R284-R287 PolarHBondContact O-N 3.19Å; R287-R289 VanDerWaalsContact C-N 3.35Å; R287-R289 PolarHBondContact O-N 3.27Å; R287-L290 PolarHBondContact O-N 3.36Å; R287-F291 HydrophobicContact CG-CD2 3.59Å; R287-F291 HydrophobicContact CG-CE2 3.34Å; R287-F291 HydrophobicContact CG-CZ 4.45Å; R287-F291 WeakPolarHBondContact O-CD2 3.2Å; R287-F291 PolarHBondContact O-N 3.25Å |
| 288 | T | 83.4 | Confident | 78.7 | Confident | 83 Ų | 83 | 70.9 Ų | 70.9 | 51% | 0.509 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.2 | -40.4 | 178.4 | -60.9 | 0 | 0 | 0 | 0 | 111.8 | R284 V286 S292 | R284-T288 WeakPolarHBondContact O-CB 3.23Å; R284-T288 PolarHBondContact O-N 3.21Å; R284-T288 PolarHBondContact O-OG1 3.26Å; R284-T288 VanDerWaalsContact O-OG1 3.04Å; V286-T288 PolarHBondContact O-N 3.14Å; T288-S292 PolarHBondContact O-N 3.36Å |
| 289 | R | 85.8 | Confident | 76.9 | Confident | 90 Ų | 90 | 74.1 Ų | 74.1 | 34% | 0.34 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -68.6 | -40 | 176.4 | -67 | -176.5 | 180 | -163 | -0.7 | 111.9 | W39 D41 A285 V286 R287 S292 L293 | W39-R289 HydrophobicContact CH2-CB 3.62Å; W39-R289 HydrophobicContact CZ2-CB 3.32Å; W39-R289 HydrophobicContact CZ2-CG 4.35Å; W39-R289 HydrophobicContact CZ3-CB 4.35Å; D41-R289 IonicContact OD2-CZ 3.59Å; D41-R289 IonicContact OD2-NH1 3.15Å; D41-R289 PolarHBondContact OD2-NH1 3.19Å; D41-R289 VanDerWaalsContact OD2-NH1 3.15Å; D41-R289 IonicContact OD2-NH2 3.01Å; D41-R289 PolarHBondContact OD2-NH2 3.45Å; A285-R289 WeakPolarHBondContact O-CG 3.42Å; V286-R289 PolarHBondContact O-N 3.31Å; R287-R289 VanDerWaalsContact C-N 3.35Å; R287-R289 PolarHBondContact O-N 3.27Å; R289-S292 PolarHBondContact O-N 2.87Å; R289-L293 WeakPolarHBondContact O-CG 3.34Å; R289-L293 PolarHBondContact O-N 2.96Å |
| 290 | L | 86.3 | Confident | 74.9 | Confident | 36 Ų | 36 | 78.7 Ų | 78.7 | 19% | 0.188 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -60.6 | -48 | 173.7 | -75.2 | 175.1 | 0 | 0 | 0 | 111.8 | L31 T35 W39 V280 V286 R287 S292 L293 C294 | L31-L290 HydrophobicContact CD1-CD1 4.28Å; L31-L290 HydrophobicContact CD1-CD2 3.96Å; L31-L290 HydrophobicContact CD2-CD1 4.19Å; T35-L290 HydrophobicContact CG2-CD2 4.2Å; W39-L290 HydrophobicContact CH2-CD2 3.83Å; W39-L290 HydrophobicContact CH2-CG 3.85Å; V280-L290 HydrophobicContact CG1-CD1 3.4Å; V280-L290 VanDerWaalsContact CG1-CD1 3.4Å; V286-L290 HydrophobicContact CG1-CD1 4.1Å; V286-L290 HydrophobicContact CG1-CG 4.47Å; V286-L290 PolarHBondContact O-N 2.93Å; R287-L290 PolarHBondContact O-N 3.36Å; L290-S292 VanDerWaalsContact C-N 3.3Å; L290-S292 PolarHBondContact O-N 3.17Å; L290-L293 PolarHBondContact O-N 3.34Å; L290-L293 VanDerWaalsContact O-N 3.16Å; L290-C294 PolarHBondContact O-N 3.36Å; L290-C294 PolarHBondContact O-SG 3.24Å; L290-C294 VanDerWaalsContact O-SG 3.34Å |
| 291 | F | 86.6 | Confident | 73.1 | Confident | 125 Ų | 125 | 86.6 Ų | 86.6 | 55% | 0.548 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.4 | -41.5 | 176.5 | -82.5 | -59.8 | 0 | 0 | 0 | 112.1 | R287 L293 C294 C295 | R287-F291 HydrophobicContact CG-CD2 3.59Å; R287-F291 HydrophobicContact CG-CE2 3.34Å; R287-F291 HydrophobicContact CG-CZ 4.45Å; R287-F291 WeakPolarHBondContact O-CD2 3.2Å; R287-F291 PolarHBondContact O-N 3.25Å; F291-L293 VanDerWaalsContact C-N 3.33Å; F291-L293 PolarHBondContact O-N 3.03Å; F291-C294 PolarHBondContact O-N 3.03Å; F291-C295 WeakPolarHBondContact O-CB 3.47Å; F291-C295 PolarHBondContact O-N 3.39Å; F291-C295 PolarHBondContact O-SG 3.35Å |
| 292 | S | 84.6 | Confident | 71.1 | Confident | 69 Ų | 69 | 87.3 Ų | 87.3 | 48% | 0.483 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.5 | -43.4 | 175.6 | -171.3 | 0 | 0 | 0 | 0 | 112.1 | T288 R289 L290 C295 C296 | T288-S292 PolarHBondContact O-N 3.36Å; R289-S292 PolarHBondContact O-N 2.87Å; L290-S292 VanDerWaalsContact C-N 3.3Å; L290-S292 PolarHBondContact O-N 3.17Å; S292-C295 PolarHBondContact O-N 3.2Å; S292-C296 WeakPolarHBondContact O-CB 3.45Å; S292-C296 PolarHBondContact O-N 3.23Å; S292-C296 PolarHBondContact O-SG 3.42Å |
| 293 | L | 83.4 | Confident | 69.1 | Low | 83 Ų | 83 | 90.3 Ų | 90.3 | 44% | 0.435 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.8 | -45 | 177.4 | -70.4 | 172.3 | 0 | 0 | 0 | 111.5 | W39 R289 L290 F291 C295 C296 C297 | W39-L293 HydrophobicContact CZ2-CD1 3.75Å; R289-L293 WeakPolarHBondContact O-CG 3.34Å; R289-L293 PolarHBondContact O-N 2.96Å; L290-L293 PolarHBondContact O-N 3.34Å; L290-L293 VanDerWaalsContact O-N 3.16Å; F291-L293 VanDerWaalsContact C-N 3.33Å; F291-L293 PolarHBondContact O-N 3.03Å; L293-C295 PolarHBondContact O-N 3.16Å; L293-C296 PolarHBondContact O-N 2.89Å; L293-C297 PolarHBondContact O-N 3.12Å; L293-C297 PolarHBondContact O-SG 3.31Å |
| 294 | C | 81.7 | Confident | 67.1 | Low | 76 Ų | 76 | 95.8 Ų | 95.8 | 51% | 0.514 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.3 | -41.6 | 176.6 | -64.7 | 0 | 0 | 0 | 0 | 112 | L290 F291 C297 C298 | L290-C294 PolarHBondContact O-N 3.36Å; L290-C294 PolarHBondContact O-SG 3.24Å; L290-C294 VanDerWaalsContact O-SG 3.34Å; F291-C294 PolarHBondContact O-N 3.03Å; C294-C297 PolarHBondContact O-N 3.23Å; C294-C298 PolarHBondContact O-N 2.67Å; C294-C298 VanDerWaalsContact O-N 3.1Å; C294-C298 PolarHBondContact O-SG 2.97Å |
| 295 | C | 76.1 | Confident | 65.2 | Low | 73 Ų | 73 | 96 Ų | 96 | 49% | 0.493 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.9 | -38.6 | 177.3 | -68.8 | 0 | 0 | 0 | 0 | 112.5 | F291 S292 L293 C297 C298 S299 | F291-C295 WeakPolarHBondContact O-CB 3.47Å; F291-C295 PolarHBondContact O-N 3.39Å; F291-C295 PolarHBondContact O-SG 3.35Å; S292-C295 PolarHBondContact O-N 3.2Å; L293-C295 PolarHBondContact O-N 3.16Å; C295-C297 VanDerWaalsContact C-N 3.33Å; C295-C297 PolarHBondContact O-N 2.96Å; C295-C298 CarbonylContact O-C 3.56Å; C295-C298 PolarHBondContact O-N 2.74Å; C295-C298 VanDerWaalsContact O-N 3.14Å; C295-S299 WeakPolarHBondContact O-CB 3.34Å; C295-S299 PolarHBondContact O-N 3.18Å; C295-S299 PolarHBondContact O-OG 2.94Å |
| 296 | C | 62.3 | Low | 63.5 | Low | 83 Ų | 83 | 98.7 Ų | 98.7 | 56% | 0.561 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -65.3 | -35.4 | 174.4 | -69.5 | 0 | 0 | 0 | 0 | 112.3 | S292 L293 C298 S299 | S292-C296 WeakPolarHBondContact O-CB 3.45Å; S292-C296 PolarHBondContact O-N 3.23Å; S292-C296 PolarHBondContact O-SG 3.42Å; L293-C296 PolarHBondContact O-N 2.89Å; C296-C298 VanDerWaalsContact C-N 3.31Å; C296-S299 PolarHBondContact O-N 3.37Å |
| 297 | C | 56.3 | Low | 61.6 | Low | 102 Ų | 102 | 104.5 Ų | 104.5 | 69% | 0.689 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -67.3 | -30.7 | 172 | -65.1 | 0 | 0 | 0 | 0 | 112.5 | L293 C294 C295 | L293-C297 PolarHBondContact O-N 3.12Å; L293-C297 PolarHBondContact O-SG 3.31Å; C294-C297 PolarHBondContact O-N 3.23Å; C295-C297 VanDerWaalsContact C-N 3.33Å; C295-C297 PolarHBondContact O-N 2.96Å |
| 298 | C | 52.9 | Low | 59.5 | Low | 112 Ų | 112 | 104.6 Ų | 104.6 | 76% | 0.757 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -85.7 | -14.8 | 177.2 | -63.4 | 0 | 0 | 0 | 0 | 114.6 | C294 C295 C296 | C294-C298 PolarHBondContact O-N 2.67Å; C294-C298 VanDerWaalsContact O-N 3.1Å; C294-C298 PolarHBondContact O-SG 2.97Å; C295-C298 CarbonylContact O-C 3.56Å; C295-C298 PolarHBondContact O-N 2.74Å; C295-C298 VanDerWaalsContact O-N 3.14Å; C296-C298 VanDerWaalsContact C-N 3.31Å |
| 299 | S | 47.7 | Very low | 57 | Low | 92 Ų | 92 | 104.4 Ų | 104.4 | 64% | 0.643 | 65% | 0.648 | S | S | * | * | trans | -107.4 | 30.6 | -177.5 | -66.4 | 0 | 0 | 0 | 0 | 114.2 | C295 C296 Q301 | C295-S299 WeakPolarHBondContact O-CB 3.34Å; C295-S299 PolarHBondContact O-N 3.18Å; C295-S299 PolarHBondContact O-OG 2.94Å; C296-S299 PolarHBondContact O-N 3.37Å; S299-Q301 PolarHBondContact O-N 3.06Å | ||
| 300 | S | 40.3 | Very low | 54.8 | Low | 103 Ų | 103 | 106.6 Ų | 106.6 | 72% | 0.72 | 67% | 0.671 | S | S | * | * | trans | -73.8 | 75 | 168 | -57.4 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 301 | Q | 43.6 | Very low | 53.3 | Low | 167 Ų | 167 | 110.2 Ų | 110.2 | 78% | 0.78 | 70% | 0.697 | S | S | * | * | trans | -77.5 | 138.9 | 160 | -80.5 | -148.2 | -18.5 | 0 | 0 | 109.4 | S299 | S299-Q301 PolarHBondContact O-N 3.06Š| ||
| 302 | P | 40 | Very low | 50.7 | Low | 102 Ų | 102 | 114.2 Ų | 114.2 | 66% | 0.662 | 71% | 0.714 | S | S | * | * | trans | -65.4 | 148.4 | 173.4 | 28.3 | -31.9 | 0 | 0 | 0 | 109.6 | T304 | P302-T304 PolarHBondContact O-N 3.04Š| ||
| 303 | P | 38.8 | Very low | 48.7 | Very low | 128 Ų | 128 | 115.6 Ų | 115.6 | 83% | 0.831 | 73% | 0.73 | S | S | * | * | trans | -65.5 | 107 | -179 | 26.2 | -31.9 | 0 | 0 | 0 | 109.6 | K305 | P303-K305 PolarHBondContact O-N 3.49Š| ||
| 304 | T | 36.8 | Very low | 46.6 | Very low | 127 Ų | 127 | 117.6 Ų | 117.6 | 78% | 0.779 | 75% | 0.748 | S | S | * | * | trans | -68.2 | 114.2 | 166.1 | 30.4 | 0 | 0 | 0 | 0 | 108.2 | P302 S306 | P302-T304 PolarHBondContact O-N 3.04Å; T304-S306 PolarHBondContact O-N 3.02Å | ||
| 305 | K | 37.8 | Very low | 44.6 | Very low | 198 Ų | 198 | 118.5 Ų | 118.5 | 86% | 0.861 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -47.2 | 122.6 | 174.1 | -66.3 | 174.9 | 175.6 | 178 | 0 | 110.6 | P303 | P303-K305 PolarHBondContact O-N 3.49Š|
| 306 | S | 41.8 | Very low | 43 | Very low | 116 Ų | 116 | 120.5 Ų | 120.5 | 81% | 0.811 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 131 | 157.8 | -67.4 | 0 | 0 | 0 | 0 | 109.4 | T304 | T304-S306 PolarHBondContact O-N 3.02Š|
| 307 | P | 40.1 | Very low | 41.6 | Very low | 125 Ų | 125 | 121.8 Ų | 121.8 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -80.8 | 127.8 | 158.5 | -4.1 | 22.8 | 0 | 0 | 0 | 108.9 | ||
| 308 | A | 42.7 | Very low | 40.6 | Very low | 106 Ų | 106 | 126.4 Ų | 126.4 | 88% | 0.876 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 146.5 | 168.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 309 | G | 32.3 | Very low | 40.1 | Very low | 79 Ų | 79 | 127.4 Ų | 127.4 | 81% | 0.814 | 80% | 0.796 | S | S | * | * | trans | -174.3 | 79.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 310 | T | 38.6 | Very low | 39.3 | Very low | 137 Ų | 137 | 126.2 Ų | 126.2 | 84% | 0.84 | 80% | 0.798 | S | S | * | * | trans | -75 | 176.1 | 167.2 | 34.9 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 311 | P | 55.4 | Low | 39 | Very low | 111 Ų | 111 | 130.9 Ų | 130.9 | 72% | 0.721 | 81% | 0.808 | S | S | * | * | -131.7 | 163.8 | -58 | 36.8 | -20.4 | 0 | 0 | 0 | 111 | |||||
| 312 | K | 31.5 | Very low | 38.4 | Very low | 210 Ų | 210 | 128.8 Ų | 128.8 | 91% | 0.913 | 81% | 0.812 | S | S | * | * | trans | -161.8 | 118.5 | 154 | -116 | 169.6 | -173.5 | -179.2 | 0 | 112.2 | ||||
| 313 | A | 43.3 | Very low | 38.1 | Very low | 98 Ų | 98 | 133 Ų | 133 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | trans | -75.7 | 156.7 | 166.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 314 | P | 38.5 | Very low | 37.7 | Very low | 125 Ų | 125 | 136.4 Ų | 136.4 | 81% | 0.812 | 83% | 0.828 | S | S | * | * | trans | -123.4 | 133.1 | 140.8 | 15.2 | 4.5 | 0 | 0 | 0 | 111.3 | ||||
| 315 | A | 39.6 | Very low | 37.3 | Very low | 94 Ų | 94 | 138.4 Ų | 138.4 | 78% | 0.777 | 83% | 0.826 | S | S | * | * | trans | -64.9 | 161.7 | 162.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 316 | P | 43 | Very low | 37 | Very low | 115 Ų | 115 | 136.9 Ų | 136.9 | 75% | 0.747 | 82% | 0.822 | S | S | * | * | -151.1 | 157.3 | 103.6 | 35.9 | -17.2 | 0 | 0 | 0 | 118 | |||||
| 317 | S | 32.3 | Very low | 36.4 | Very low | 110 Ų | 110 | 135.2 Ų | 135.2 | 77% | 0.769 | 82% | 0.822 | S | S | * | * | trans | 65.8 | 117.5 | 142.5 | 55.3 | 0 | 0 | 0 | 0 | 122.8 | ||||
| 318 | K | 36.7 | Very low | 36.1 | Very low | 200 Ų | 200 | 135.9 Ų | 135.9 | 87% | 0.87 | 82% | 0.824 | S | S | * | * | trans | -68.7 | 158.8 | 154.1 | -71 | -175.7 | 171.7 | -176.7 | 0 | 111.3 | ||||
| 319 | P | 40.7 | Very low | 36.3 | Very low | 133 Ų | 133 | 137 Ų | 137 | 86% | 0.864 | 82% | 0.823 | S | S | * | * | -133.4 | 157.2 | 88.3 | 29.1 | -12 | 0 | 0 | 0 | 110.2 | |||||
| 320 | G | 31.9 | Very low | 36.3 | Very low | 66 Ų | 66 | 136.8 Ų | 136.8 | 68% | 0.68 | 82% | 0.82 | S | S | * | * | cis | 142.4 | 117 | 23.6 | 0 | 0 | 0 | 0 | 0 | 103.8 | ||||
| 321 | E | 32.8 | Very low | 36.2 | Very low | 202 Ų | 202 | 139.7 Ų | 139.7 | 94% | 0.944 | 82% | 0.824 | S | S | * | * | trans | -157.2 | 141.8 | 169.1 | -121.6 | 173.2 | -172.7 | 0 | 0 | 110.7 | ||||
| 322 | S | 32.4 | Very low | 35.4 | Very low | 122 Ų | 122 | 141.2 Ų | 141.2 | 85% | 0.853 | 83% | 0.826 | S | S | * | * | trans | -87.5 | 162.4 | -156.4 | -57.7 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 323 | Q | 33.8 | Very low | 36.4 | Very low | 190 Ų | 190 | 137 Ų | 137 | 89% | 0.888 | 82% | 0.82 | S | S | * | * | trans | -51.2 | 145.8 | 177 | -67 | 164.2 | -43 | 0 | 0 | 114.8 | ||||
| 324 | E | 29.9 | Very low | 36.2 | Very low | 201 Ų | 201 | 137 Ų | 137 | 94% | 0.939 | 81% | 0.814 | S | S | * | * | -156.2 | 142 | 127.7 | -131.9 | 173.1 | 166.9 | 0 | 0 | 111.7 | |||||
| 325 | F | 28 | Very low | 36.3 | Very low | 168 Ų | 168 | 141.4 Ų | 141.4 | 74% | 0.737 | 84% | 0.839 | S | S | * | * | trans | -126.4 | 137.6 | -168.8 | -175.1 | -107.9 | 0 | 0 | 0 | 110 | ||||
| 326 | Q | 31.8 | Very low | 36.2 | Very low | 167 Ų | 167 | 143.8 Ų | 143.8 | 78% | 0.78 | 84% | 0.842 | S | S | * | * | trans | 65.9 | 133.9 | 153.8 | -88.3 | -174 | -7.1 | 0 | 0 | 123.2 | ||||
| 327 | G | 28.6 | Very low | 35.8 | Very low | 80 Ų | 80 | 145.3 Ų | 145.3 | 83% | 0.825 | 85% | 0.847 | S | S | * | * | trans | 161.9 | 85.7 | 143.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 328 | T | 34.8 | Very low | 36 | Very low | 139 Ų | 139 | 147.3 Ų | 147.3 | 85% | 0.853 | 85% | 0.851 | S | S | * | * | trans | -74.7 | 159.6 | 150.2 | 9.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 329 | P | 45.8 | Very low | 36 | Very low | 130 Ų | 130 | 144.2 Ų | 144.2 | 84% | 0.844 | 85% | 0.85 | S | S | * | * | -153.6 | 178.9 | 53.1 | 37.3 | -14.2 | 0 | 0 | 0 | 116.7 | |||||
| 330 | G | 33 | Very low | 35.7 | Very low | 74 Ų | 74 | 144.9 Ų | 144.9 | 76% | 0.763 | 85% | 0.85 | S | S | * | * | trans | 145.8 | 106.1 | 150.3 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 331 | E | 36.5 | Very low | 35.9 | Very low | 198 Ų | 198 | 150.1 Ų | 150.1 | 93% | 0.925 | 86% | 0.861 | S | S | * | * | trans | -9.8 | 151 | 161 | -77.9 | 167.8 | 112.8 | 0 | 0 | 124.6 | ||||
| 332 | L | 38.7 | Very low | 36.2 | Very low | 144 Ų | 144 | 146.4 Ų | 146.4 | 75% | 0.754 | 86% | 0.855 | S | S | * | * | trans | -42.9 | 169 | 158.2 | -114.3 | 90.9 | 0 | 0 | 0 | 115.1 | ||||
| 333 | P | 52.2 | Low | 36.4 | Very low | 121 Ų | 121 | 148.3 Ų | 148.3 | 79% | 0.786 | 86% | 0.855 | S | S | * | * | -151 | 174.1 | 55.2 | 38.6 | -14.8 | 0 | 0 | 0 | 119.7 | |||||
| 334 | S | 38.8 | Very low | 36.7 | Very low | 97 Ų | 97 | 144.8 Ų | 144.8 | 68% | 0.678 | 85% | 0.852 | S | S | * | * | trans | -43 | 143.9 | 174.7 | -43.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 335 | T | 42 | Very low | 37.3 | Very low | 219 Ų | 219 | 139.7 Ų | 139.7 | 100% | 1.344 | 84% | 0.844 | S | S | * | * | -150 | 0 | 126.6 | 43.1 | 0 | 0 | 0 | 0 | 108.8 |
Retrieved 335 of 335 residues in 301.9 ms
(Link to these results)